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atk:vnl-atk_2016年发表文章列表 [2016/09/21 21:36] – [详细列表] dong.dongatk:vnl-atk_2016年发表文章列表 [2018/03/20 18:23] (当前版本) – [VNL-ATK 2016年发表文章列表] liu.jun
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-====== VNL-ATK 2016年发表文章列表 ======+====== QuantumATK 2016年发表文章列表 ======
  
-===== 统计 =====+===== 高影响因子杂志文章统计(截至2016年9月) =====
  
   * Nature Materials 1篇   * Nature Materials 1篇
行 12: 行 12:
   * RSC Advances 10篇   * RSC Advances 10篇
   * Nanoscale 2篇   * Nanoscale 2篇
-  * Carbon 4+  * Carbon 5
   * Advanced Materials 1篇   * Advanced Materials 1篇
  
 ===== 详细列表 ===== ===== 详细列表 =====
  
-  - Jain, Sumit Kumar, Anurag Srivastava, and O. P. Sinha. "Bandgap Tuning of SWCNT (5, 5) Through Boron Doping: Ab-Initio Analysis." Quantum Matter5.3 (2016): 406-410. +  - Jain, Sumit Kumar, Anurag Srivastava, and O. P. Sinha. "Bandgap Tuning of SWCNT (5, 5) Through Boron Doping: Ab-Initio Analysis." **Quantum Matter** 5.3 (2016): 406-410. 
-  - Randhawa, Gagandeep Singh, and Sukhdeep Kaur Gurbani. "Investigation of the Thermal Transport in Hybrid Silicene-Germanene Nanoribbon to Enhance its Thermoelectric Performance." International Journal of Engineering Science 8078 (2016). +  - Randhawa, Gagandeep Singh, and Sukhdeep Kaur Gurbani. "Investigation of the Thermal Transport in Hybrid Silicene-Germanene Nanoribbon to Enhance its Thermoelectric Performance." **International Journal of Engineering Science** 8078 (2016). 
-  - Gupta, Priya, et al. "Ab-Initio Analysis of Electronic Properties of CdO Nanotubes." Quantum Matter 5.3 (2016): 372-374.+  - Gupta, Priya, et al. "Ab-Initio Analysis of Electronic Properties of CdO Nanotubes." **Quantum Matter** 5.3 (2016): 372-374.
   - Sharma, Varshali. "Analysis of electronic properties of different configurations of CNTS with undoped and doped atom." 2ND INTERNATIONAL CONFERENCE ON EMERGING TECHNOLOGIES: MICRO TO NANO 2015 (ETMN-2015): Contributory papers presented in 2nd International Conference on Emerging Technologies: Micro to Nano 2015. Vol. 1724. No. 1. AIP Publishing, 2016.   - Sharma, Varshali. "Analysis of electronic properties of different configurations of CNTS with undoped and doped atom." 2ND INTERNATIONAL CONFERENCE ON EMERGING TECHNOLOGIES: MICRO TO NANO 2015 (ETMN-2015): Contributory papers presented in 2nd International Conference on Emerging Technologies: Micro to Nano 2015. Vol. 1724. No. 1. AIP Publishing, 2016.
   - Sharma, Varshali. "Analysis of electronic properties of different configurations of CNTS with undoped and doped atom." 2ND INTERNATIONAL CONFERENCE ON EMERGING TECHNOLOGIES: MICRO TO NANO 2015 (ETMN-2015): Contributory papers presented in 2nd International Conference on Emerging Technologies: Micro to Nano 2015. Vol. 1724. No. 1. AIP Publishing, 2016.   - Sharma, Varshali. "Analysis of electronic properties of different configurations of CNTS with undoped and doped atom." 2ND INTERNATIONAL CONFERENCE ON EMERGING TECHNOLOGIES: MICRO TO NANO 2015 (ETMN-2015): Contributory papers presented in 2nd International Conference on Emerging Technologies: Micro to Nano 2015. Vol. 1724. No. 1. AIP Publishing, 2016.
   - Guo, Caixia, et al. "Tuning anisotropic electronic transport properties of phosphorene via substitutional doping." Physical Chemistry Chemical Physics (2016).   - Guo, Caixia, et al. "Tuning anisotropic electronic transport properties of phosphorene via substitutional doping." Physical Chemistry Chemical Physics (2016).
   - Taluja, Yogita, et al. "Defect and functionalized graphene for supercapacitor electrodes." Superlattices and Microstructures 98 (2016): 306-315.   - Taluja, Yogita, et al. "Defect and functionalized graphene for supercapacitor electrodes." Superlattices and Microstructures 98 (2016): 306-315.
-  - SanthiBhushan, Boddepalli, et al. "First Principle Analysis of (10-Boranylanthracene-9-yl) borane-Based Molecular Single-Electron Transistor for High-Speed Low-Power Electronics." IEEE Transactions on Electron Devices 63.3 (2016): 1232-1238.+  - SanthiBhushan, Boddepalli, et al. "First Principle Analysis of (10-Boranylanthracene-9-yl) borane-Based Molecular Single-Electron Transistor for High-Speed Low-Power Electronics." **IEEE Transactions on Electron Devices** 63.3 (2016): 1232-1238.
   - Sinha, Swati, Jaya Bandyopadhyay, and Debashis De. "DNA Computing Using Carbon Nanotube-DNA Hybrid Nanostructure." Handbook of Research on Natural Computing for Optimization Problems. IGI Global, 2016. 744-774. 书   - Sinha, Swati, Jaya Bandyopadhyay, and Debashis De. "DNA Computing Using Carbon Nanotube-DNA Hybrid Nanostructure." Handbook of Research on Natural Computing for Optimization Problems. IGI Global, 2016. 744-774. 书
-  - Srivastava, Pankaj, Avaneesh Kumar, and Neeraj K. Jaiswal. "Structural, electronic, and magnetic properties of Mn-Doped InP nanowire."Superlattices and Microstructures 92 (2016): 134-142. +  - Srivastava, Pankaj, Avaneesh Kumar, and Neeraj K. Jaiswal. "Structural, electronic, and magnetic properties of Mn-Doped InP nanowire." **Superlattices and Microstructures** 92 (2016): 134-142. 
-  - Yu, Sheng, et al. "Strain-engineering the anisotropic electrical conductance in ReS2 monolayer." Applied Physics Letters 108.19 (2016): 191901. +  - Yu, Sheng, et al. "Strain-engineering the anisotropic electrical conductance in ReS2 monolayer." **Applied Physics Letters** 108.19 (2016): 191901. 
-  - Refaat, Marjan, and Mohammad Reza Moslemi. "A simulation study of silver nanowire for water and ethane vapor sensing." Microelectronics International33.2 (2016). +  - Refaat, Marjan, and Mohammad Reza Moslemi. "A simulation study of silver nanowire for water and ethane vapor sensing." **Microelectronics International** 33.2 (2016). 
-  - Kausar, Sana, and Shirish Joshi. "Effect of Al Doping on Electrical Properties of Si Nanochain." Quantum Matter 5.3 (2016): 330-334. +  - Kausar, Sana, and Shirish Joshi. "Effect of Al Doping on Electrical Properties of Si Nanochain." **Quantum Matter** 5.3 (2016): 330-334. 
-  - Srivastava, Pankaj, et al. "First‐principles study of electronic properties of GaN nanowires: Effect of surface orientation, passivation, and Mn doping."physica status solidi (b) (2016). +  - Srivastava, Pankaj, et al. "First‐principles study of electronic properties of GaN nanowires: Effect of surface orientation, passivation, and Mn doping." **physica status solidi** (b) (2016). 
-  - Deng, X. Q., et al. "The design of bipolar spin filtering junction in zigzag silicene nanoribbons." Organic Electronics 37 (2016): 245-251. +  - Deng, X. Q., et al. "The design of bipolar spin filtering junction in zigzag silicene nanoribbons." **Organic Electronics** 37 (2016): 245-251. 
-  - Zhao, Peng, De-Sheng Liu, and Gang Chen. "Spin-polarized transport properties of Fe-oligoporphyrin dimer-based molecular device." Organic Electronics 36 (2016): 160-165. +  - Zhao, Peng, De-Sheng Liu, and Gang Chen. "Spin-polarized transport properties of Fe-oligoporphyrin dimer-based molecular device." **Organic Electronics** 36 (2016): 160-165. 
-  - Zhai, Bao-gai, Chen Tang, and Yuan Ming Huang. "First-principles density functional calculations of the band structures of SrAl2O4." Optoelectron. Mater. 1 (2016) 18–21 +  - Zhai, Bao-gai, Chen Tang, and Yuan Ming Huang. "First-principles density functional calculations of the band structures of SrAl2O4." **Optoelectron. Mater.** 1 (2016) 18–21 
-  - Zhu, Z., et al. "Magnetic structures and magnetic device properties of edge-modified armchair-edged graphene nanoribbons." Carbon 106 (2016): 252-259. +  - Zhu, Z., et al. "Magnetic structures and magnetic device properties of edge-modified armchair-edged graphene nanoribbons." **Carbon** 106 (2016): 252-259. 
-  - Srivastava, Anurag, et al. "Influence of Boron Substitution on Conductance of Pyridine-and Pentane-Based Molecular Single Electron Transistors: First-Principles Analysis." Journal of Electronic Materials 45.4 (2016): 2233-2241. +  - Srivastava, Anurag, et al. "Influence of Boron Substitution on Conductance of Pyridine-and Pentane-Based Molecular Single Electron Transistors: First-Principles Analysis." **Journal of Electronic Materials** 45.4 (2016): 2233-2241. 
-  - Shah, Khurshed A., and M. Shunaid Parvaiz. "Computational comparative study of substitutional, endo and exo BN Co-Doped single walled carbon nanotube system." Superlattices and Microstructures 93 (2016): 234-241. +  - Shah, Khurshed A., and M. Shunaid Parvaiz. "Computational comparative study of substitutional, endo and exo BN Co-Doped single walled carbon nanotube system." **Superlattices and Microstructures** 93 (2016): 234-241. 
-  - Shen, Ji-Mei, et al. "Some methods to regulate low-bias negative differential resistance in σ barrier separating nanoscale molecular transport systems."International Journal of Modern Physics B 30.2 (2016): 1550256. +  - Shen, Ji-Mei, et al. "Some methods to regulate low-bias negative differential resistance in σ barrier separating nanoscale molecular transport systems." **International Journal of Modern Physics** B 30.2 (2016): 1550256. 
-  - An, Yipeng, et al. "Rectifications in organic single-molecule diodes alkanethiolate-terminated heterocyclics." Physics Letters A 380.7 (2016): 923-926. +  - An, Yipeng, et al. "Rectifications in organic single-molecule diodes alkanethiolate-terminated heterocyclics." **Physics Letters A** 380.7 (2016): 923-926. 
-  - Shen, Ji-Mei, et al. "Study on nitrogen doped carbon atom chains with negative differential resistance effect." Physics Letters A 380.22 (2016): 1981-1984. +  - Shen, Ji-Mei, et al. "Study on nitrogen doped carbon atom chains with negative differential resistance effect." **Physics Letters A** 380.22 (2016): 1981-1984. 
-  - Min, Y., et al. "Strong n-type molecule as low bias negative differential resistance device predicted by first-principles study." Physica E: Low-dimensional Systems and Nanostructures (2016). +  - Min, Y., et al. "Strong n-type molecule as low bias negative differential resistance device predicted by first-principles study." **Physica E: Low-dimensional Systems and Nanostructures** (2016). 
-  - Min, Y., et al. "A new method to induce molecular low bias negative differential resistance with multi-peaks." The Journal of chemical physics144.6 (2016): 064308. +  - Min, Y., et al. "A new method to induce molecular low bias negative differential resistance with multi-peaks." **The Journal of chemical physics** 144.6 (2016): 064308. 
-  - Zhu, Jingyi, et al. "Defect‐Engineered Graphene for High‐Energy‐and High‐Power‐Density Supercapacitor Devices." Advanced Materials 28.33 (2016): 7185-7192. +  - Zhu, Jingyi, et al. "Defect‐Engineered Graphene for High‐Energy‐and High‐Power‐Density Supercapacitor Devices." **Advanced Materials** 28.33 (2016): 7185-7192. 
-  - Fang, Y., L. Y. Zhang, and H. L. Zhang. "Predicting the interface structure of Nb thin film grown on MgO (110) substrate." Materials Letters 183 (2016): 338-340. +  - Fang, Y., L. Y. Zhang, and H. L. Zhang. "Predicting the interface structure of Nb thin film grown on MgO (110) substrate." **Materials Letters** 183 (2016): 338-340. 
-  - Paudel, Samir, et al. "Magnetism in zigzag and armchair CuO nanotubes: Ab-initio study." Journal of Magnetism and Magnetic Materials 406 (2016): 8-14. +  - Paudel, Samir, et al. "Magnetism in zigzag and armchair CuO nanotubes: Ab-initio study." **Journal of Magnetism and Magnetic Materials** 406 (2016): 8-14. 
-  - Kutlu, E., et al. "Effect of substitutional As impurity on electrical and optical properties of β-Si 3 N 4 structure." Materials Research Bulletin (2016). +  - Kutlu, E., et al. "Effect of substitutional As impurity on electrical and optical properties of β-Si 3 N 4 structure." **Materials Research Bulletin** (2016). 
-  - Xia, Cai-Juan, et al. "Electronic transport properties of a single chiroptical molecular switch with graphene nanoribbons electrodes." Optik-International Journal for Light and Electron Optics 127.11 (2016): 4774-4777. +  - Xia, Cai-Juan, et al. "Electronic transport properties of a single chiroptical molecular switch with graphene nanoribbons electrodes." **Optik-International Journal for Light and Electron Optics** 127.11 (2016): 4774-4777. 
-  - Yuan, Peipei, et al. "Reverse rectification and negative differential resistance effects in doped armchair graphene ribbons device." Applied Physics A122.9 (2016): 863. +  - Yuan, Peipei, et al. "Reverse rectification and negative differential resistance effects in doped armchair graphene ribbons device." **Applied Physics A** 122.9 (2016): 863. 
-  - An, Yipeng, et al. "Electronic transport properties of the first all-boron fullerene B 40 and its metallofullerene Sr@ B 40." Physical Chemistry Chemical Physics 18.17 (2016): 12024-12028. +  - An, Yipeng, et al. "Electronic transport properties of the first all-boron fullerene B 40 and its metallofullerene Sr@ B 40." **Physical Chemistry Chemical Physics** 18.17 (2016): 12024-12028. 
-  - Zheng, Ya-Peng, Bao-An Bian, and Pei-Pei Yuan. "Electronic transport properties of a quinone-based molecular switch." The European Physical Journal B 89.9 (2016): 191. +  - Zheng, Ya-Peng, Bao-An Bian, and Pei-Pei Yuan. "Electronic transport properties of a quinone-based molecular switch." **The European Physical Journal B** 89.9 (2016): 191. 
-  - Xia, Cai-Juan, et al. "Effect of Chirality on the Electronic Transport Properties of the Thioxanthene-Based Molecular Switch" Chinese Physics Letters 33.4 (2016): 047101. +  - Xia, Cai-Juan, et al. "Effect of Chirality on the Electronic Transport Properties of the Thioxanthene-Based Molecular Switch" **Chinese Physics Letters** 33.4 (2016): 047101. 
-  - Berdiyorov, Golibjon R., Mohamed E. Madjet, and Khaled A. Mahmoud. "Ionic sieving through Ti3C2 (OH) 2 MXene: First-principles calculations."Applied Physics Letters 108.11 (2016): 113110. +  - Berdiyorov, Golibjon R., Mohamed E. Madjet, and Khaled A. Mahmoud. "Ionic sieving through Ti3C2 (OH) 2 MXene: First-principles calculations." **Applied Physics Letters** 108.11 (2016): 113110. 
-  - Chakraverty, Mayank, et al. "Simulation of Electrical Characteristics of Silicon and Germanium Nanowires Progressively Doped to Zener Diode Configuration Using First Principle Calculations." Microelectronics, Electromagnetics and Telecommunications. Springer India, 2016. 421-428. +  - Chakraverty, Mayank, et al. "Simulation of Electrical Characteristics of Silicon and Germanium Nanowires Progressively Doped to Zener Diode Configuration Using First Principle Calculations." **Microelectronics, Electromagnetics and Telecommunications.** Springer India, 2016. 421-428. 
-  - Aghaei, Sadegh Mehdi, and Irene Calizo. "Density Functional Theory Study on Energy Band Gap of Armchair Silicene Nanoribbons with Periodic Nanoholes." MRS Advances: 1-6. +  - Aghaei, Sadegh Mehdi, and Irene Calizo. "Density Functional Theory Study on Energy Band Gap of Armchair Silicene Nanoribbons with Periodic Nanoholes." **MRS Advances**: 1-6. 
-  - He, Jing-Jing, et al. "The electron transport properties of zigzag graphene nanoribbons with upright standing linear carbon chains." Solid State Communications 227 (2016): 28-32. +  - He, Jing-Jing, et al. "The electron transport properties of zigzag graphene nanoribbons with upright standing linear carbon chains." **Solid State Communications** 227 (2016): 28-32. 
-  - Berdiyorov, Golibjon R., and Mohamed El-Amine Madjet. "First-principles study of electronic transport and optical properties of penta-graphene, penta-SiC 2 and penta-CN 2." RSC Advances 6.56 (2016): 50867-50873. +  - Berdiyorov, Golibjon R., and Mohamed El-Amine Madjet. "First-principles study of electronic transport and optical properties of penta-graphene, penta-SiC 2 and penta-CN 2." **RSC Advances** 6.56 (2016): 50867-50873. 
-  - Khan, Md Shahzad, Anurag Srivastava, and Ravindra Pandey. "Electronic properties of a pristine and NH 3/NO 2 adsorbed buckled arsenene monolayer." RSC Advances 6.76 (2016): 72634-72642. +  - Khan, Md Shahzad, Anurag Srivastava, and Ravindra Pandey. "Electronic properties of a pristine and NH 3/NO 2 adsorbed buckled arsenene monolayer." **RSC Advances** 6.76 (2016): 72634-72642. 
-  - Choudhary, Sudhanshu, and Divya Kaushik. "Understanding the effect of vacancy defects on spin transport in CrO2–graphene–CrO2 magnetic tunnel junction." Modern Physics Letters B 30.09 (2016): 1650102. +  - Choudhary, Sudhanshu, and Divya Kaushik. "Understanding the effect of vacancy defects on spin transport in CrO2–graphene–CrO2 magnetic tunnel junction." **Modern Physics Letters** B 30.09 (2016): 1650102. 
-  - Zhang, Leining, et al. "Electronic transport properties of ultra-thin Ni and Ni–C nanowires." Physical Chemistry Chemical Physics 18.7 (2016): 5336-5343. +  - Zhang, Leining, et al. "Electronic transport properties of ultra-thin Ni and Ni–C nanowires." **Physical Chemistry Chemical Physics** 18.7 (2016): 5336-5343. 
-  - Wang, Wei, Yan-Dong Guo, and Xiao-Hong Yan. "The spin-dependent transport of transition metal encapsulated B 40 fullerene." RSC Advances6.46 (2016): 40155-40161. +  - Wang, Wei, Yan-Dong Guo, and Xiao-Hong Yan. "The spin-dependent transport of transition metal encapsulated B 40 fullerene." **RSC Advances** 6.46 (2016): 40155-40161. 
-  - Zhu, Sicong, et al. "The electronic transport and Spin Seebeck Effect of MnAs (001)/InP (001) heterogeneous junctions." Journal of Alloys and Compounds 655 (2016): 32-37. +  - Zhu, Sicong, et al. "The electronic transport and Spin Seebeck Effect of MnAs (001)/InP (001) heterogeneous junctions." **Journal of Alloys and Compounds** 655 (2016): 32-37. 
-  - Berdiyorov, Golibjon R., et al. "Role of Cations on the Electronic Transport and Optical Properties of the Lead-Iodide Perovskite." The Journal of Physical Chemistry C (2016). +  - Berdiyorov, Golibjon R., et al. "Role of Cations on the Electronic Transport and Optical Properties of the Lead-Iodide Perovskite." The Journal of Physical Chemist 
-  - Width and defect effects on the electronic transport of zigzag MoS2 nanoribbons +  - Width and defect effects on the electronic transport of zigzag MoS2 nanoribbonsry C (2016). 
-  - An, Yipeng, et al. "Width and defect effects on the electronic transport of zigzag MoS2 nanoribbons." Journal of Physics D: Applied Physics 49.24 (2016): 245304. +  - An, Yipeng, et al. "Width and defect effects on the electronic transport of zigzag MoS2 nanoribbons." **Journal of Physics D: Applied Physics** 49.24 (2016): 245304. 
-  - Wang, Lihua, et al. "The Effects of Negative Differential Resistance, Bipolar Spin-Filtering, and Spin-Rectifying on Step-Like Zigzag Graphene Nanoribbons Heterojunctions with Single or Double Edge-Saturated Hydrogen." Journal of Electronic Materials (2016): 1-9. +  - Wang, Lihua, et al. "The Effects of Negative Differential Resistance, Bipolar Spin-Filtering, and Spin-Rectifying on Step-Like Zigzag Graphene Nanoribbons Heterojunctions with Single or Double Edge-Saturated Hydrogen." **Journal of Electronic Materials** (2016): 1-9. 
-  - Choudhary, Sudhanshu, Pradeep Mishra, and Rohit Goyal. "First-principles study of spin transport in BN doped CrO 2–graphene–CrO 2 magnetic tunnel junction." Physics Letters A 380.9 (2016): 1098-1101. +  - Choudhary, Sudhanshu, Pradeep Mishra, and Rohit Goyal. "First-principles study of spin transport in BN doped CrO 2–graphene–CrO 2 magnetic tunnel junction." **Physics Letters A** 380.9 (2016): 1098-1101. 
-  - Wu, QiuHua, Peng Zhao, and DeSheng Liu. "Spin-dependent transport properties in a pyrene–graphene nanoribbon device." RSC Advances 6.20 (2016): 16634-16639. +  - Wu, QiuHua, Peng Zhao, and DeSheng Liu. "Spin-dependent transport properties in a pyrene–graphene nanoribbon device." ** RSC Advances** 6.20 (2016): 16634-16639. 
-  - Zeng, Jing, and Ke-Qiu Chen. "Interesting odd-even rules of spin-filtering and magnetoresistance effects in a single-molecule spintronic device." Carbon104 (2016): 20-26. +  - Zeng, Jing, and Ke-Qiu Chen. "Interesting odd-even rules of spin-filtering and magnetoresistance effects in a single-molecule spintronic device." **Carbon** 104 (2016): 20-26. 
-  - Yuan, Weiqing, et al. "Energy gap of novel edge-defected graphene nanoribbons." Japanese Journal of Applied Physics 55.8 (2016): 085101. +  - Yuan, Weiqing, et al. "Energy gap of novel edge-defected graphene nanoribbons." **Japanese Journal of Applied Physics** 55.8 (2016): 085101. 
-  - Yan, Qiang, et al. "High spin-filter efficiency and Seebeck effect through spin-crossover iron–benzene complex." The Journal of Chemical Physics144.15 (2016): 154304. +  - Yan, Qiang, et al. "High spin-filter efficiency and Seebeck effect through spin-crossover iron–benzene complex." **The Journal of Chemical Physics** 144.15 (2016): 154304. 
-  - Xie, Fang, et al. "Tunable negative differential resistance in a single cruciform diamine molecule with zigzag graphene nanoribbon electrodes."RSC Advances 6.88 (2016): 84978-84984. +  - Xie, Fang, et al. "Tunable negative differential resistance in a single cruciform diamine molecule with zigzag graphene nanoribbon electrodes." **RSC Advances** 6.88 (2016): 84978-84984. 
-  - Cheng, Xue-Mei, et al. "Hydroxyl induced edge magnetism and metallicity in armchair MoS2 nanoribbons." Journal of Physics D: Applied Physics 49.11 (2016): 115303. +  - Cheng, Xue-Mei, et al. "Hydroxyl induced edge magnetism and metallicity in armchair MoS2 nanoribbons." **Journal of Physics D: Applied Physics** 49.11 (2016): 115303. 
-  - Wang, Lihua, et al. "Negative differential resistance effect in similar right triangle graphene devices." Journal of Computational Electronics (2016): 1-7. +  - Wang, Lihua, et al. "Negative differential resistance effect in similar right triangle graphene devices." **Journal of Computational Electronics** (2016): 1-7. 
-  - El-Nahas, Ahmed M., Aleksandar Staykov, and Kazunari Yoshizawa. "First-Principles Calculations of Electron Transport through Azulene." The Journal of Physical Chemistry C 120.17 (2016): 9043-9052.+  - El-Nahas, Ahmed M., Aleksandar Staykov, and Kazunari Yoshizawa. "First-Principles Calculations of Electron Transport through Azulene." **The Journal of Physical Chemistry C** 120.17 (2016): 9043-9052.
   - Szafranski, Mateusz, Adam Kawalec, and Andrzej Dukata. "Modelling Carbon Nanotube coated structures. Comparison of simulation methods."2016 21st International Conference on Microwave, Radar and Wireless Communications (MIKON). IEEE, 2016.   - Szafranski, Mateusz, Adam Kawalec, and Andrzej Dukata. "Modelling Carbon Nanotube coated structures. Comparison of simulation methods."2016 21st International Conference on Microwave, Radar and Wireless Communications (MIKON). IEEE, 2016.
-  - Deng, X. Q., et al. "Modulation of the spin transport properties of the iron-phthalocyanine molecular junction by carbon chains with different connection sites." Organic Electronics 35 (2016): 1-5. +  - Deng, X. Q., et al. "Modulation of the spin transport properties of the iron-phthalocyanine molecular junction by carbon chains with different connection sites." **Organic Electronics** 35 (2016): 1-5. 
-  - Parashar, Sweta, and Pankaj Srivastava. "A novel reverse rectifying effects and negative differential resistance in asymmetric X-biphenyl-X (X= Pt, Pd, Pb) molecular junctions." Solid State Communications 231 (2016): 10-13. +  - Parashar, Sweta, and Pankaj Srivastava. "A novel reverse rectifying effects and negative differential resistance in asymmetric X-biphenyl-X (X= Pt, Pd, Pb) molecular junctions." **Solid State Communications** 231 (2016): 10-13. 
-  - Berdiyorov, G. R., et al. "Electronic transport in organometallic perovskite CH3NH3PbI3: The role of organic cation orientations." Applied Physics Letters 108.5 (2016): 053901. +  - Berdiyorov, G. R., et al. "Electronic transport in organometallic perovskite CH3NH3PbI3: The role of organic cation orientations." **Applied Physics Letters** 108.5 (2016): 053901. 
-  - Ni, Yun, et al. "Spin-filter and negative differential resistance effect in zigzag-edged bilayer graphene nanoribbon devices." AIP Advances 6.2 (2016): 025216. +  - Ni, Yun, et al. "Spin-filter and negative differential resistance effect in zigzag-edged bilayer graphene nanoribbon devices." **AIP Advances** 6.2 (2016): 025216. 
-  - Berdiyorov, G. R., et al. "Effect of halide-mixing on the electronic transport properties of organometallic perovskites." Solar Energy Materials and Solar Cells 148 (2016): 2-10. +  - Berdiyorov, G. R., et al. "Effect of halide-mixing on the electronic transport properties of organometallic perovskites." **Solar Energy Materials and Solar Cells** 148 (2016): 2-10. 
-  - Liang, Xiu Yan, et al. "Polysilane-Wrapped Carbon and Boron-Nitride Nanotubes: Effects of B or P Doping on Electron Transport." The Journal of Physical Chemistry C 120.10 (2016): 5741-5754. +  - Liang, Xiu Yan, et al. "Polysilane-Wrapped Carbon and Boron-Nitride Nanotubes: Effects of B or P Doping on Electron Transport." **The Journal of Physical Chemistry C** 120.10 (2016): 5741-5754. 
-  - Wang, Lihua, et al. "Nitrogen Doping Position-Dependent Rectification of Spin-Polarized Current and Realization of Multifunction in Zigzag Graphene Nanoribbons with Asymmetric Edge Hydrogenation." Journal of Electronic Materials 45.2 (2016): 1165-1174. +  - Wang, Lihua, et al. "Nitrogen Doping Position-Dependent Rectification of Spin-Polarized Current and Realization of Multifunction in Zigzag Graphene Nanoribbons with Asymmetric Edge Hydrogenation." **Journal of Electronic Materials** 45.2 (2016): 1165-1174. 
-  - Chen, Wei, et al. "Spin-dependent transport properties in covalent–organic molecular device with graphene nanoribbon electrodes." Computational and Theoretical Chemistry 1091 (2016): 85-91. +  - Chen, Wei, et al. "Spin-dependent transport properties in covalent–organic molecular device with graphene nanoribbon electrodes." **Computational and Theoretical Chemistry** 1091 (2016): 85-91. 
-  - Berdiyorov, G. R., et al. "Effect of crystal structure on the electronic transport properties of the organometallic perovskite CH 3 NH 3 PbI 3." Solar Energy Materials and Solar Cells 148 (2016): 60-66. +  - Berdiyorov, G. R., et al. "Effect of crystal structure on the electronic transport properties of the organometallic perovskite CH 3 NH 3 PbI 3." **Solar Energy Materials and Solar Cells** 148 (2016): 60-66. 
-  - Zeng, Jing, et al. "Light-driven strong spin valve effects in an azobenzene-based spin optoelectronic device." Journal of Physics D: Applied Physics49.41 (2016): 415104. +  - Zeng, Jing, et al. "Light-driven strong spin valve effects in an azobenzene-based spin optoelectronic device." **Journal of Physics D: Applied Physics** 49.41 (2016): 415104. 
-  - Berdiyorov, G. R., H. Bahlouli, and F. M. Peeters. "Effect of substitutional impurities on the electronic transport properties of graphene." Physica E: Low-dimensional Systems and Nanostructures 84 (2016): 22-26. +  - Berdiyorov, G. R., H. Bahlouli, and F. M. Peeters. "Effect of substitutional impurities on the electronic transport properties of graphene." **Physica E: Low-dimensional Systems and Nanostructures** 84 (2016): 22-26. 
-  - Gracia-Espino, Eduardo, et al. "Electron transport study on functionalized armchair graphene nanoribbons: DFT calculations." RSC Advances 6.26 (2016): 21954-21960. +  - Gracia-Espino, Eduardo, et al. "Electron transport study on functionalized armchair graphene nanoribbons: DFT calculations." **RSC Advances** 6.26 (2016): 21954-21960. 
-  - Wang, Lihua, et al. "Vertex-Atom-Dependent Rectification in Triangular h-BNC/Triangular Graphene Heterojunctions." Journal of Electronic Materials(2016): 1-7. +  - Wang, Lihua, et al. "Vertex-Atom-Dependent Rectification in Triangular h-BNC/Triangular Graphene Heterojunctions." **Journal of Electronic Materials** (2016): 1-7. 
-  - Maity, Ajanta, et al. "Structural, electronic, mechanical, and transport properties of phosphorene nanoribbons: Negative differential resistance behavior." Physical Review B 94.7 (2016): 075422. +  - Maity, Ajanta, et al. "Structural, electronic, mechanical, and transport properties of phosphorene nanoribbons: Negative differential resistance behavior." **Physical Review B** 94.7 (2016): 075422. 
-  - Lei, Sidong, et al. "Surface functionalization of two-dimensional metal chalcogenides by Lewis acid–base chemistry." Nature nanotechnology 11.5 (2016): 465-471. +  - Lei, Sidong, et al. "Surface functionalization of two-dimensional metal chalcogenides by Lewis acid–base chemistry." **Nature nanotechnology** 11.5 (2016): 465-471. 
-  - Jiang, X. W., Q. Yang, and J. X. Cao. "The effect of domain walls on leakage current in PbTiO 3 thin films." Physics Letters A 380.9 (2016): 1071-1074. +  - Jiang, X. W., Q. Yang, and J. X. Cao. "The effect of domain walls on leakage current in PbTiO 3 thin films." **Physics Letters A** 380.9 (2016): 1071-1074. 
-  - Rai, Hari Mohan, et al. "Possibility of spin-polarized transport in edge fluorinated armchair boron nitride nanoribbons." RSC Advances 6.13 (2016): 11014-11022. +  - Rai, Hari Mohan, et al. "Possibility of spin-polarized transport in edge fluorinated armchair boron nitride nanoribbons." **RSC Advances** 6.13 (2016): 11014-11022. 
-  - Qiu, Ming, et al. "Band gap opening and semiconductor–metal phase transition in (n, n) single-walled carbon nanotubes with distinctive boron–nitrogen line defect." Physical Chemistry Chemical Physics 18.6 (2016): 4643-4651. +  - Qiu, Ming, et al. "Band gap opening and semiconductor–metal phase transition in (n, n) single-walled carbon nanotubes with distinctive boron–nitrogen line defect." **Physical Chemistry Chemical Physics** 18.6 (2016): 4643-4651. 
-  - Ghorbani-Asl, Mahdi, et al. "Effect of compression on the electronic, optical and transport properties of MoS2/graphene-based junctions." 2D Materials3.2 (2016): 025018. +  - Ghorbani-Asl, Mahdi, et al. "Effect of compression on the electronic, optical and transport properties of MoS2/graphene-based junctions." **2D Materials** 3.2 (2016): 025018. 
-  - Zhou, Yi, JiChen Dong, and Hui Li. "Multifunctional heterostructures constructed using MoS2 and WS2 nanoribbons." Physical Chemistry Chemical Physics (2016). +  - Zhou, Yi, JiChen Dong, and Hui Li. "Multifunctional heterostructures constructed using MoS2 and WS2 nanoribbons." **Physical Chemistry Chemical Physics** (2016). 
-  - Zhang, Dan, et al. "Spin-resolved transport properties in zigzag α-graphyne nanoribbons with symmetric and asymmetric edge fluorinations." RSC Advances 6.18 (2016): 15008-15015. +  - Zhang, Dan, et al. "Spin-resolved transport properties in zigzag α-graphyne nanoribbons with symmetric and asymmetric edge fluorinations." **RSC Advances** 6.18 (2016): 15008-15015. 
-  - Choe, Jeongheon, et al. "Direct imaging of rotating molecules anchored on graphene." Nanoscale 8.27 (2016): 13174-13180. +  - Choe, Jeongheon, et al. "Direct imaging of rotating molecules anchored on graphene." **Nanoscale** 8.27 (2016): 13174-13180. 
-  - Hayashi, Daisuke, et al. "Thermoelectric properties of single-wall carbon nanotube films: Effects of diameter and wet environment." Applied Physics Express 9.2 (2016): 025102. +  - Hayashi, Daisuke, et al. "Thermoelectric properties of single-wall carbon nanotube films: Effects of diameter and wet environment." **Applied Physics Express** 9.2 (2016): 025102. 
-  - Liu, N., et al. "Efficient spin-filter and negative differential resistance behaviors in FeN4 embedded graphene nanoribbon device." Journal of Applied Physics 119.10 (2016): 104301. +  - Liu, N., et al. "Efficient spin-filter and negative differential resistance behaviors in FeN4 embedded graphene nanoribbon device." **Journal of Applied Physics** 119.10 (2016): 104301. 
-  - Berdiyorov, G. R., and M. E. Madjet. "Structural, electronic transport and optical properties of functionalized quasi-2D TiC 2 from first-principles calculations." Applied Surface Science (2016). +  - Berdiyorov, G. R., and M. E. Madjet. "Structural, electronic transport and optical properties of functionalized quasi-2D TiC 2 from first-principles calculations." **Applied Surface Science** (2016). 
-  - Zeng, Jing, Fang Xie, and Ke-Qiu Chen. "High-efficiency spin-filtering and magnetoresistance effects in supramolecular spin valves." Carbon 98 (2016): 607-612. +  - Zeng, Jing, Fang Xie, and Ke-Qiu Chen. "High-efficiency spin-filtering and magnetoresistance effects in supramolecular spin valves." **Carbon** 98 (2016): 607-612. 
-  - Li, Jie, et al. "Distinctive Electron Transport on Pyridine-Linked Molecular Junction with Narrow Monolayer Graphene Nanoribbons Electrodes Compared with Metal Electrodes and Graphene Electrodes." Physical Chemistry Chemical Physics (2016). +  - Li, Jie, et al. "Distinctive Electron Transport on Pyridine-Linked Molecular Junction with Narrow Monolayer Graphene Nanoribbons Electrodes Compared with Metal Electrodes and Graphene Electrodes." **Physical Chemistry Chemical Physics** (2016). 
-  - Zeng, Jing, Ke-Qiu Chen, and Mengqiu Long. "Hydrogen tautomerization: A simple approach to tune spin-filtering effects in a quinone-based spintronic device." Organic Electronics 35 (2016): 12-16. +  - Zeng, Jing, Ke-Qiu Chen, and Mengqiu Long. "Hydrogen tautomerization: A simple approach to tune spin-filtering effects in a quinone-based spintronic device." **Organic Electronics** 35 (2016): 12-16. 
-  - Wang, Lihua, et al. "Tuning electronic transport of zigzag graphene nanoribbons by ordered B or N atom doping." Journal of Computational Electronics (2016): 1-7. +  - Wang, Lihua, et al. "Tuning electronic transport of zigzag graphene nanoribbons by ordered B or N atom doping." **Journal of Computational Electronics** (2016): 1-7. 
-  - Sakata, Kaoruho, et al. "The effects of uniaxial and biaxial strain on the electronic structure of germanium." Computational Materials Science 112 (2016): 263-268. +  - Sakata, Kaoruho, et al. "The effects of uniaxial and biaxial strain on the electronic structure of germanium." **Computational Materials Science** 112 (2016): 263-268. 
-  - Matsuura, Yukihito. "Electronic transport properties of silicon clusters."Chemical Physics Letters 645 (2016): 97-99. +  - Matsuura, Yukihito. "Electronic transport properties of silicon clusters." **Chemical Physics Letters** 645 (2016): 97-99. 
-  - Yuan, Jianmei, et al. "Computational design of smallest nanotube junctions in 0.3 nm diameter." Materials & Design 95 (2016): 641-647. +  - Yuan, Jianmei, et al. "Computational design of smallest nanotube junctions in 0.3 nm diameter." **Materials & Design** 95 (2016): 641-647. 
-  - Tan, Chang-Ming, et al. "Spin filtering and rectifying effects in the zinc methyl phenalenyl molecule between graphene nanoribbon leads." Organic Electronics 28 (2016): 244-251. +  - Tan, Chang-Ming, et al. "Spin filtering and rectifying effects in the zinc methyl phenalenyl molecule between graphene nanoribbon leads." **Organic Electronics** 28 (2016): 244-251. 
-  - Jiang, Cheng-Huan, et al. "Structure and Spin-Polarized Transport of Co Atomic Chains on Graphene with Topological Line Defects." Journal of Cluster Science 27.3 (2016): 875-882. +  - Jiang, Cheng-Huan, et al. "Structure and Spin-Polarized Transport of Co Atomic Chains on Graphene with Topological Line Defects." **Journal of Cluster Science** 27.3 (2016): 875-882. 
-  - Bansal, Akansha, et al. "First Principles Calculations of Bonding and Charges at the Al 2 Interface in a c-Si/SiO 2 O 3 Interface in a c-Si/SiO 2/am-Al 2 O 3 Structure Applicable for the Surface Passivation of Silicon-Based Solar Cells." IEEE Transactions on Electron Devices 63.2 (2016): 544-550. +  - Bansal, Akansha, et al. "First Principles Calculations of Bonding and Charges at the Al 2 Interface in a c-Si/SiO 2 O 3 Interface in a c-Si/SiO 2/am-Al 2 O 3 Structure Applicable for the Surface Passivation of Silicon-Based Solar Cells." **IEEE Transactions on Electron Devices** 63.2 (2016): 544-550. 
-  - Liu, Y., et al. "Electronic and transport features of zigzag boron nitride nanoribbons with nonmetallic atom terminations." Organic Electronics 38 (2016): 292-300. +  - Liu, Y., et al. "Electronic and transport features of zigzag boron nitride nanoribbons with nonmetallic atom terminations." **Organic Electronics** 38 (2016): 292-300. 
-  - Izawa, Tetsumi, Kengo Takashima, and Takahiro Yamamoto. "Edge‐disorder‐induced optimization of thermoelectric performance of finite‐length graphene nanoribbons." Surface and Interface Analysis (2016). +  - Izawa, Tetsumi, Kengo Takashima, and Takahiro Yamamoto. "Edge‐disorder‐induced optimization of thermoelectric performance of finite‐length graphene nanoribbons." **Surface and Interface Analysis** (2016). 
-  - Berdiyorov, G. R. "Optical properties of functionalized Ti3C2T2 (T= F, O, OH) MXene: First-principles calculations." AIP Advances 6.5 (2016): 055105. +  - Berdiyorov, G. R. "Optical properties of functionalized Ti3C2T2 (T= F, O, OH) MXene: First-principles calculations." **AIP Advances** 6.5 (2016): 055105. 
-  - Yang, Zhi, et al. "The thermal properties and thermoelectric performance of γ-graphyne nanoribbons." Journal of Physics D: Applied Physics 49.14 (2016): 145102. +  - Yang, Zhi, et al. "The thermal properties and thermoelectric performance of γ-graphyne nanoribbons." **Journal of Physics D: Applied Physics** 49.14 (2016): 145102. 
-  - Srivastava, Pankaj, Subhra Dhar, and Neeraj K. Jaiswal. "Half metallic transition in silver-adsorbed zigzag graphene nanoribbons." Adv. Mater. Lett. 2016, 7(9), 708-712 +  - Srivastava, Pankaj, Subhra Dhar, and Neeraj K. Jaiswal. "Half metallic transition in silver-adsorbed zigzag graphene nanoribbons." **Adv. Mater. Lett.** 2016, 7(9), 708-712 
-  - Zeng, Qingyi, et al. "The transport properties of the Phosphorus and Chlorine doped single layer MoS 2 p–n junctions: A first-principles study." Solid State Communications 246 (2016): 82-87. +  - Zeng, Qingyi, et al. "The transport properties of the Phosphorus and Chlorine doped single layer MoS 2 p–n junctions: A first-principles study." **Solid State Communications** 246 (2016): 82-87. 
-  - Parveen, Nadia, et al. "Single-atom conductance of Y." Physica B: Condensed Matter 488 (2016): 57-61. +  - Parveen, Nadia, et al. "Single-atom conductance of Y." **Physica B: Condensed Matter** 488 (2016): 57-61. 
-  - Xie, Fang, et al. "Effects of stretching and compression on conducting properties of an Au–alkanedithiol–Au molecular junction." Chemical Physics467 (2016): 21-25. +  - Xie, Fang, et al. "Effects of stretching and compression on conducting properties of an Au–alkanedithiol–Au molecular junction." **Chemical Physics** 467 (2016): 21-25. 
-  - Cheng, Jue-Fei, et al. "The electron and spin polarized transport in wide-voltage-ranges through colbaltporphyrin-based molecular junctions." The Journal of chemical physics 144.8 (2016): 084707. +  - Cheng, Jue-Fei, et al. "The electron and spin polarized transport in wide-voltage-ranges through colbaltporphyrin-based molecular junctions." **The Journal of chemical physics** 144.8 (2016): 084707. 
-  - Ouyang, Jun, et al. "Modulating the spin transport behaviors in ZBNCNRs by edge hydrogenation and position of BN chain." AIP Advances 6.3 (2016): 035116. +  - Ouyang, Jun, et al. "Modulating the spin transport behaviors in ZBNCNRs by edge hydrogenation and position of BN chain." **AIP Advances** 6.3 (2016): 035116. 
-  - Shang, Yan, et al. "Electronic and transport properties of [V (Bz) 2] n@ SWCNT and [V (Bz) 2] n@ DWCNT nanocables." RSC Advances 6.50 (2016): 44041-44049. +  - Shang, Yan, et al. "Electronic and transport properties of [V (Bz) 2] n@ SWCNT and [V (Bz) 2] n@ DWCNT nanocables." **RSC Advances** 6.50 (2016): 44041-44049. 
-  - Zhang, W. Q., et al. "Interface effect on leakage current of ferroelectric film."Computational Materials Science 115 (2016): 120-124. +  - Zhang, W. Q., et al. "Interface effect on leakage current of ferroelectric film." **Computational Materials Science** 115 (2016): 120-124. 
-  - Fan, Zhi-Qiang, et al. "Giant decreasing of spin current in a single molecular junction with twisted zigzag graphene nanoribbon electrodes." Carbon 110 (2016): 200-206. +  - Fan, Zhi-Qiang, et al. "Giant decreasing of spin current in a single molecular junction with twisted zigzag graphene nanoribbon electrodes." **Carbon** 110 (2016): 200-206. 
-  - Liu, J., et al. "Insight into negative differential resistance in polyphenylene molecular device with graphene electrodes." Organic Electronics 33 (2016): 1-8. +  - Liu, J., et al. "Insight into negative differential resistance in polyphenylene molecular device with graphene electrodes." **Organic Electronics** 33 (2016): 1-8. 
-  - Gan, Tian, et al. "Electronic and transport properties of the (VBz) n@ MoS 2 NT nanocable." Physical Chemistry Chemical Physics 18.6 (2016): 4385-4393. +  - Gan, Tian, et al. "Electronic and transport properties of the (VBz) n@ MoS 2 NT nanocable." **Physical Chemistry Chemical Physics** 18.6 (2016): 4385-4393. 
-  - Hariharan, R. M., and D. John Thiruvadigal. "Effect of anchoring atom and electrostatic gating on the electronic transport properties in single molecular electronic devices." Journal of Materials Science: Materials in Electronics(2016): 1-9. +  - Hariharan, R. M., and D. John Thiruvadigal. "Effect of anchoring atom and electrostatic gating on the electronic transport properties in single molecular electronic devices." **Journal of Materials Science: Materials in Electronics** (2016): 1-9. 
-  - Liu, Wenjiang, Xiaoqing Deng, and Shaohong Cai. "Transport properties for carbon chain sandwiched between heteroatom-doped carbon nanotubes with different doping sites." AIP Advances 6.7 (2016): 075103. +  - Liu, Wenjiang, Xiaoqing Deng, and Shaohong Cai. "Transport properties for carbon chain sandwiched between heteroatom-doped carbon nanotubes with different doping sites." **AIP Advances** 6.7 (2016): 075103. 
-  - Gunst, Tue, et al. "First-principles method for electron-phonon coupling and electron mobility: Applications to two-dimensional materials." Physical Review B 93.3 (2016): 035414. +  - Gunst, Tue, et al. "First-principles method for electron-phonon coupling and electron mobility: Applications to two-dimensional materials." **Physical Review B** 93.3 (2016): 035414. 
-  - Matsuura, Yukihito. "Tunneling magnetoresistance of silicon chains." Journal of Applied Physics 119.20 (2016): 205501. +  - Matsuura, Yukihito. "Tunneling magnetoresistance of silicon chains." **Journal of Applied Physics** 119.20 (2016): 205501. 
-  - Lu, Anh Khoa Augustin, et al. "Origin of the performances degradation of two-dimensional-based metal-oxide-semiconductor field effect transistors in the sub-10 nm regime: A first-principles study." Applied Physics Letters108.4 (2016): 043504. +  - Lu, Anh Khoa Augustin, et al. "Origin of the performances degradation of two-dimensional-based metal-oxide-semiconductor field effect transistors in the sub-10 nm regime: A first-principles study." **Applied Physics Letters** 108.4 (2016): 043504. 
-  - Deng, X. Q., et al. "Spin-filtering and rectifying effects for Al-doped zigzag-edged silicene nanoribbons with asymmetric edge hydrogenation." Organic Electronics 32 (2016): 41-46. +  - Deng, X. Q., et al. "Spin-filtering and rectifying effects for Al-doped zigzag-edged silicene nanoribbons with asymmetric edge hydrogenation." **Organic Electronics** 32 (2016): 41-46. 
-  - Tang, Qide, et al. "Charge transport properties of graphene: Effects of Cu-based gate electrode." Journal of Applied Physics 120.3 (2016): 035101. +  - Tang, Qide, et al. "Charge transport properties of graphene: Effects of Cu-based gate electrode." **Journal of Applied Physics** 120.3 (2016): 035101. 
-  - Li, Xin-Mei, et al. "Effects of line defects on spin-dependent electronic transport of zigzag MoS2 nanoribbons." AIP Advances 6.1 (2016): 015015. +  - Li, Xin-Mei, et al. "Effects of line defects on spin-dependent electronic transport of zigzag MoS2 nanoribbons." **AIP Advances** 6.1 (2016): 015015. 
-  - An, Yipeng, et al. "The magnetism and spin-dependent electronic transport properties of boron nitride atomic chains." The Journal of Chemical Physics145.4 (2016): 044301. +  - An, Yipeng, et al. "The magnetism and spin-dependent electronic transport properties of boron nitride atomic chains." **The Journal of Chemical Physics** 145.4 (2016): 044301. 
-  - Harada, Naoki, and Shintaro Sato. "Electronic properties of NH4-adsorbed graphene nanoribbon as a promising candidate for a gas sensor." AIP Advances 6.5 (2016): 055023. +  - Harada, Naoki, and Shintaro Sato. "Electronic properties of NH4-adsorbed graphene nanoribbon as a promising candidate for a gas sensor." **AIP Advances** 6.5 (2016): 055023. 
-  - Jiang, Liming, et al. "Feasibility study of molecular memory device based on DNA using methylation to store information." Journal of Applied Physics120.2 (2016): 025501. +  - Jiang, Liming, et al. "Feasibility study of molecular memory device based on DNA using methylation to store information." **Journal of Applied Physics** 120.2 (2016): 025501. 
-  - Sun, Cuicui, et al. "Electronic and transport properties of PSi@ MoS 2 nanocables." Physical Chemistry Chemical Physics 18.6 (2016): 4333-4344. +  - Sun, Cuicui, et al. "Electronic and transport properties of PSi@ MoS 2 nanocables." **Physical Chemistry Chemical Physics** 18.6 (2016): 4333-4344. 
-  - Ji, Xiao-Li, et al. "Giant rectification in graphene nanoflake molecular devices with asymmetric graphene nanoribbon electrodes." Physics Letters A 380.39 (2016): 3198-3205. +  - Ji, Xiao-Li, et al. "Giant rectification in graphene nanoflake molecular devices with asymmetric graphene nanoribbon electrodes." **Physics Letters A** 380.39 (2016): 3198-3205. 
-  - Zhou, Yuhong, et al. "Negative differential resistance and rectifying performance induced by doped graphene nanoribbons p–n device." Physics Letters A 380.9 (2016): 1049-1055.+  - Zhou, Yuhong, et al. "Negative differential resistance and rectifying performance induced by doped graphene nanoribbons p–n device." **Physics Letters A** 380.9 (2016): 1049-1055.
   - Al-Dirini, Feras, et al. "Monolayer MoS2 self-switching diodes." Journal of Applied Physics 119.4 (2016): 044506.   - Al-Dirini, Feras, et al. "Monolayer MoS2 self-switching diodes." Journal of Applied Physics 119.4 (2016): 044506.
-  - Cui, Li-ling, et al. "Spin-dependent transport properties of hetero-junction based on zigzag graphene nanoribbons with edge hydrogenation and oxidation." Physics Letters A 380.5 (2016): 730-738. +  - Cui, Li-ling, et al. "Spin-dependent transport properties of hetero-junction based on zigzag graphene nanoribbons with edge hydrogenation and oxidation." **Physics Letters A** 380.5 (2016): 730-738. 
-  - Zahir, Ali, et al. "EE-BESD: molecular FET modeling for efficient and effective nanocomputing design." Journal of Computational Electronics 15.2 (2016): 479-491.+  - Zahir, Ali, et al. "EE-BESD: molecular FET modeling for efficient and effective nanocomputing design." **Journal of Computational Electronics** 15.2 (2016): 479-491.
   - Structral Stability of Functionalized Silicene Nanoribbons with Normal, Reconstructed, and Hybrid Edges   - Structral Stability of Functionalized Silicene Nanoribbons with Normal, Reconstructed, and Hybrid Edges
-  - Sadegh Mehdi Aghaei, Ingrid Torres, and Irene Calizo +  - Ray, S. J. "First-principles study of MoS 2, phosphorene and graphene based single electron transistor for gas sensing applications." **Sensors and Actuators B: Chemical** 222 (2016): 492-498. 
-  - Received 21 March 2016; Accepted 28 August 2016 +  - Ray, S. J., M. Venkata Kamalakar, and R. Chowdhury. "Ab initio studies of phoshorene island single electron transistor." **Journal of Physics: Condensed Matter** 28.19 (2016): 195302. 
-  - Academic Editor: Yasuhiko Hayashi Journal of Nanomaterials +  - Zhai, Bao-gai, et al. "Mechanism of the prolongation of the green afterglow of SrAl 2 O 4: Dy 3+ caused by the use of H 3 BO 3 flux." **Journal of Luminescence** (2016). 
-  - Ray, S. J. "First-principles study of MoS 2, phosphorene and graphene based single electron transistor for gas sensing applications." Sensors and Actuators B: Chemical 222 (2016): 492-498. +  - Dey, Debarati, et al. "A First Principle Approach to Design Gated pin Nanodiode." **Journal of Nano Research.** Vol. 36. Trans Tech Publications, 2016. 
-  - Ray, S. J., M. Venkata Kamalakar, and R. Chowdhury. "Ab initio studies of phoshorene island single electron transistor." Journal of Physics: Condensed Matter 28.19 (2016): 195302. +  - Zhang, Han, et al. "Magnetoresistance in Co/2D MoS 2/Co and Ni/2D MoS 2/Ni junctions." **Physical Chemistry Chemical Physics** (2016). 
-  - Zhai, Bao-gai, et al. "Mechanism of the prolongation of the green afterglow of SrAl 2 O 4: Dy 3+ caused by the use of H 3 BO 3 flux." Journal of Luminescence (2016). +  - Tripathy, Srijeet, and Tarun Kanti Bhattacharyya. "Role of inter-tube coupling and quantum interference on electrical transport in carbon nanotube junctions." **Physica E: Low-dimensional Systems and Nanostructures** (2016). 
-  - Dey, Debarati, et al. "A First Principle Approach to Design Gated pin Nanodiode." Journal of Nano Research. Vol. 36. Trans Tech Publications, 2016. +  - Al-Dirini, Feras, et al. "Tuneable graphene nanopores for single biomolecule detection." **Nanoscale** 8.19 (2016): 10066-10077. 
-  - Zhang, Han, et al. "Magnetoresistance in Co/2D MoS 2/Co and Ni/2D MoS 2/Ni junctions." Physical Chemistry Chemical Physics (2016). +  - Bhat, Bashir Mohi Ud Din, Jehangir Rashid Dar, and Pratima Sen. "Effect of nitrogen doping and hydrogen confinement on the electronic properties of a single walled carbon nanotube." **Carbon letters** 17.1 (2016): 29-32. 
-  - Tripathy, Srijeet, and Tarun Kanti Bhattacharyya. "Role of inter-tube coupling and quantum interference on electrical transport in carbon nanotube junctions." Physica E: Low-dimensional Systems and Nanostructures (2016). +  - Biswal, Sudhansu Mohan, et al. "Study of effect of gate-length downscaling on the analog/RF performance and linearity investigation of InAs-based nanowire Tunnel FET." **Superlattices and Microstructures** 91 (2016): 319-330. 
-  - Al-Dirini, Feras, et al. "Tuneable graphene nanopores for single biomolecule detection." Nanoscale 8.19 (2016): 10066-10077. +  - Armaković, Stevan, and Sanja J. Armaković. "Investigation of boron modified graphene nanostructures; optoelectronic properties of graphene nanoparticles and transport properties of graphene nanosheets." **Journal of Physics and Chemistry of Solids** 98 (2016): 156-166. 
-  - Bhat, Bashir Mohi Ud Din, Jehangir Rashid Dar, and Pratima Sen. "Effect of nitrogen doping and hydrogen confinement on the electronic properties of a single walled carbon nanotube." Carbon letters 17.1 (2016): 29-32. +  - Velázquez, Daniel, et al. "Tailoring the emissive properties of photocathodes through materials engineering: Ultra-thin multilayers." **Applied Surface Science** 360 (2016): 762-766. 
-  - Biswal, Sudhansu Mohan, et al. "Study of effect of gate-length downscaling on the analog/RF performance and linearity investigation of InAs-based nanowire Tunnel FET." Superlattices and Microstructures 91 (2016): 319-330. +  - Jiang, Liming, et al. "Non-equilibrium tunneling in zigzag graphene nanoribbon break-junction results in spin filtering." **Journal of Applied Physics** 119.5 (2016): 053902.
-  - Armaković, Stevan, and Sanja J. Armaković. "Investigation of boron modified graphene nanostructures; optoelectronic properties of graphene nanoparticles and transport properties of graphene nanosheets." Journal of Physics and Chemistry of Solids 98 (2016): 156-166. +
-  - Velázquez, Daniel, et al. "Tailoring the emissive properties of photocathodes through materials engineering: Ultra-thin multilayers." Applied Surface Science 360 (2016): 762-766. +
-  - Jiang, Liming, et al. "Non-equilibrium tunneling in zigzag graphene nanoribbon break-junction results in spin filtering." Journal of Applied Physics 119.5 (2016): 053902.+
   - Abhinav, E. Meher, et al. "Analysis of Molecular Single-Electron Transistors Using Silicene, Graphene and Germanene." Proceedings of the Second International Conference on Computer and Communication Technologies. Springer India, 2016.   - Abhinav, E. Meher, et al. "Analysis of Molecular Single-Electron Transistors Using Silicene, Graphene and Germanene." Proceedings of the Second International Conference on Computer and Communication Technologies. Springer India, 2016.
   - MALDONADO, FRANK, and ARVIDS STASHANS. "DFT MODELING OF BENZOYL PEROXIDE ADSORPTION ON α-Cr2O3 (0001) SURFACE."Surface Review and Letters: 1650037.   - MALDONADO, FRANK, and ARVIDS STASHANS. "DFT MODELING OF BENZOYL PEROXIDE ADSORPTION ON α-Cr2O3 (0001) SURFACE."Surface Review and Letters: 1650037.
   - Abhinav, E. Meher, et al. "Analysis of Organic Molecular Single-Electron Transistor Using C4H6B2 with Different Metal Electrodes." Proceedings of the Second International Conference on Computer and Communication Technologies. Springer India, 2016.   - Abhinav, E. Meher, et al. "Analysis of Organic Molecular Single-Electron Transistor Using C4H6B2 with Different Metal Electrodes." Proceedings of the Second International Conference on Computer and Communication Technologies. Springer India, 2016.
-  - Yamacli, Serhan. "Investigation and comparison of bare-dihydrogenated junction rectifiers of graphene and silicene nanoribbons." Journal of Computational Electronics 15.2 (2016): 389-399. +  - Yamacli, Serhan. "Investigation and comparison of bare-dihydrogenated junction rectifiers of graphene and silicene nanoribbons." **Journal of Computational Electronics** 15.2 (2016): 389-399. 
-  - Jing, Ziang, et al. "Doping Effect of Graphene Nanoplatelets on Electrical Insulation Properties of Polyethylene: From Macroscopic to Molecular Scale." Materials 9.8 (2016): 680. +  - Jing, Ziang, et al. "Doping Effect of Graphene Nanoplatelets on Electrical Insulation Properties of Polyethylene: From Macroscopic to Molecular Scale." **Materials** 9.8 (2016): 680. 
-  - Khazaei, Mohammad, et al. "Nearly free electron states in MXenes."Physical Review B 93.20 (2016): 205125. +  - Khazaei, Mohammad, et al. "Nearly free electron states in MXenes." **Physical Review B** 93.20 (2016): 205125. 
-  - Li, Xinming, et al. "Large‐Area Ultrathin Graphene Films by Single‐Step Marangoni Self‐Assembly for Highly Sensitive Strain Sensing Application."Advanced Functional Materials 26.9 (2016): 1322-1329. +  - Li, Xinming, et al. "Large‐Area Ultrathin Graphene Films by Single‐Step Marangoni Self‐Assembly for Highly Sensitive Strain Sensing Application." **Advanced Functional Materials** 26.9 (2016): 1322-1329. 
-  - Cai, Zhengxu, et al. "Exceptional Single-Molecule Transport Properties of Ladder-Type Heteroacene Molecular Wires." Journal of the American Chemical Society (2016). +  - Cai, Zhengxu, et al. "Exceptional Single-Molecule Transport Properties of Ladder-Type Heteroacene Molecular Wires." **Journal of the American Chemical Society** (2016). 
-  - Sarswat, Prashant K., et al. "Dopants induced structural and optical anomalies of anisotropic edges of black phosphorous thin films and crystals." Ceramics International 42.11 (2016): 13113-13127. +  - Sarswat, Prashant K., et al. "Dopants induced structural and optical anomalies of anisotropic edges of black phosphorous thin films and crystals." **Ceramics International** 42.11 (2016): 13113-13127. 
-  - Beach, Benjamin, Dustin Sauriol, and Pedro Derosa. "Spin-Controlled Conductivity in a Thiophene-Functionalized Iron-Bis (dicarbollide)." Journal of Electronic Materials 45.4 (2016): 2150-2159. +  - Beach, Benjamin, Dustin Sauriol, and Pedro Derosa. "Spin-Controlled Conductivity in a Thiophene-Functionalized Iron-Bis (dicarbollide)." **Journal of Electronic Materials** 45.4 (2016): 2150-2159. 
-  - Zheng, Jue-Ting, et al. "Electrochemically assisted mechanically controllable break junction studies on the stacking configurations of oligo (phenylene ethynylene) s molecular junctions." Electrochimica Acta 200 (2016): 268-275. +  - Zheng, Jue-Ting, et al. "Electrochemically assisted mechanically controllable break junction studies on the stacking configurations of oligo (phenylene ethynylene) s molecular junctions." **Electrochimica Acta** 200 (2016): 268-275. 
-  - Zhang, Dan, et al. "Hydrogenations and electric field induced magnetic behaviors in armchair silicene nanoribbons." Scientific reports 6 (2016). +  - Zhang, Dan, et al. "Hydrogenations and electric field induced magnetic behaviors in armchair silicene nanoribbons." **Scientific reports** 6 (2016). 
-  - Zerveas, George, et al. "Comprehensive comparison and experimental validation of band-structure calculation methods in III–V semiconductor quantum wells." Solid-State Electronics 115 (2016): 92-102. +  - Zerveas, George, et al. "Comprehensive comparison and experimental validation of band-structure calculation methods in III–V semiconductor quantum wells." **Solid-State Electronics** 115 (2016): 92-102. 
-  - 张华林, 孙琳, and 王鼎. "含单排线缺陷锯齿型石墨烯纳米带的电磁性质." 物理学报 65.1 (2016): 16101-016101. +  - 张华林, 孙琳, and 王鼎. "含单排线缺陷锯齿型石墨烯纳米带的电磁性质." **物理学报** 65.1 (2016): 16101-016101. 
-  - Sun, Jian, Manoharan Muruganathan, and Hiroshi Mizuta. "Room temperature detection of individual molecular physisorption using suspended bilayer graphene." Science advances 2.4 (2016): e1501518. +  - Sun, Jian, Manoharan Muruganathan, and Hiroshi Mizuta. "Room temperature detection of individual molecular physisorption using suspended bilayer graphene." **Science advances** 2.4 (2016): e1501518. 
-  - Barker, James, Gregor Bollerhey, and Jan Hamaekers. "A multilevel approach to the evolutionary generation of polycrystalline structures."Computational Materials Science 114 (2016): 54-63. +  - Barker, James, Gregor Bollerhey, and Jan Hamaekers. "A multilevel approach to the evolutionary generation of polycrystalline structures." **Computational Materials Science** 114 (2016): 54-63. 
-  - Srivastava, Anurag, Hari Shankar Tewari, and Aniruddha Mukherjee. "Synthesis and Structural Characterization of Ni1–x Cd x Fe2O4: Experiment and Theory." Quantum Matter 5.3 (2016): 411-416.+  - Srivastava, Anurag, Hari Shankar Tewari, and Aniruddha Mukherjee. "Synthesis and Structural Characterization of Ni1–x Cd x Fe2O4: Experiment and Theory." **Quantum Matter** 5.3 (2016): 411-416.
   - IEEE Transactions on Nanotechnology ( Volume: 15, Issue: 5, Sept. 2016 ) Caliskan, Serkan, Sadik Guner, and Osman Gurbuz. "Electronic structure properties of doped and imperfect ZnO sheets." (2016).   - IEEE Transactions on Nanotechnology ( Volume: 15, Issue: 5, Sept. 2016 ) Caliskan, Serkan, Sadik Guner, and Osman Gurbuz. "Electronic structure properties of doped and imperfect ZnO sheets." (2016).
-  - Kobayashi, Yu, et al. "Modulation of electrical potential and conductivity in an atomic-layer semiconductor heterojunction." Scientific Reports 6 (2016). +  - Kobayashi, Yu, et al. "Modulation of electrical potential and conductivity in an atomic-layer semiconductor heterojunction." **Scientific Reports** 6 (2016). 
-  - Gibbs, Josh, et al. "Interpretation of Molecular Device Transport Calculation." Canadian Journal of Chemistry ja (2016). +  - Gibbs, Josh, et al. "Interpretation of Molecular Device Transport Calculation." **Canadian Journal of Chemistry** (2016). 
-  - 井澤哲美, 髙島健悟, and 山本貴博. "ナノ構造制御によるグラフェンナノリボンの熱電性能の最適化." 表面科学 37.8 (2016): 348-353. +  - 井澤哲美, 髙島健悟, and 山本貴博. "ナノ構造制御によるグラフェンナノリボンの熱電性能の最適化." **表面科学** 37.8 (2016): 348-353. 
-  - Sinha, Swati, et al. "On the Electronic Properties of Guanine Functionalized Zigzag Single-Walled Carbon-Nanotube." Journal of Nanoengineering and Nanomanufacturing 6.1 (2016): 3-8. +  - Sinha, Swati, et al. "On the Electronic Properties of Guanine Functionalized Zigzag Single-Walled Carbon-Nanotube." **Journal of Nanoengineering and Nanomanufacturing** 6.1 (2016): 3-8. 
-  - Yang, Lifang, Wenbo Mi, and Xiaocha Wang. "Schottky potential barrier and spin polarization at Co/antimonene interfaces." RSC Advances 6.45 (2016): 38746-38752. +  - Yang, Lifang, Wenbo Mi, and Xiaocha Wang. "Schottky potential barrier and spin polarization at Co/antimonene interfaces." **RSC Advances** 6.45 (2016): 38746-38752. 
-  - Bessis, C., et al. "Probing electron-phonon excitations in molecular junctions by quantum interference." Scientific reports 6 (2016). +  - Bessis, C., et al. "Probing electron-phonon excitations in molecular junctions by quantum interference." **Scientific reports** 6 (2016). 
-  - Zhou, Yuhong, et al. "Electronic and Transport Properties of Ti2CO2 MXene Nanoribbons." The Journal of Physical Chemistry C 120.30 (2016): 17143-17152. +  - Zhou, Yuhong, et al. "Electronic and Transport Properties of Ti2CO2 MXene Nanoribbons." **The Journal of Physical Chemistry C** 120.30 (2016): 17143-17152. 
-  - Saha, Dipankar, and Santanu Mahapatra. "Analytical insight into the lattice thermal conductivity and heat capacity of monolayer MoS 2." Physica E: Low-dimensional Systems and Nanostructures (2016). +  - Saha, Dipankar, and Santanu Mahapatra. "Analytical insight into the lattice thermal conductivity and heat capacity of monolayer MoS 2." **Physica E: Low-dimensional Systems and Nanostructures** (2016). 
-  - Yuan, Shundong, et al. "Theoretical study of electron transport properties of bimolecular junctions: Effect of molecular arrangement and species."Computational Materials Science 113 (2016): 53-59. +  - Yuan, Shundong, et al. "Theoretical study of electron transport properties of bimolecular junctions: Effect of molecular arrangement and species." **Computational Materials Science** 113 (2016): 53-59. 
-  - Kinoshita, Keiji, et al. "Theoretical Studies on the Magnetic and Conductive Properties of Crystals Containing Open-Shell Trioxotriangulene Radicals."Bulletin of the Chemical Society of Japan 0 (2016). +  - Kinoshita, Keiji, et al. "Theoretical Studies on the Magnetic and Conductive Properties of Crystals Containing Open-Shell Trioxotriangulene Radicals." **Bulletin of the Chemical Society of Japan** 0 (2016). 
-  - Engelund, Mads, et al. "Search for a Metallic Dangling-Bond Wire on H-Passivated Semiconductor Surface." The Journal of Physical Chemistry C(2016). +  - Engelund, Mads, et al. "Search for a Metallic Dangling-Bond Wire on H-Passivated Semiconductor Surface." **The Journal of Physical Chemistry C** (2016). 
-  - Koo, Joonhoi, et al. "Near‐Infrared Saturable Absorption of Defective Bulk‐Structured WTe2 for Femtosecond Laser Mode‐Locking." Advanced Functional Materials (2016). +  - Koo, Joonhoi, et al. "Near‐Infrared Saturable Absorption of Defective Bulk‐Structured WTe2 for Femtosecond Laser Mode‐Locking." **Advanced Functional Materials** (2016). 
-  - Pan, Yuanyuan, et al. "Interfacial Properties of Monolayer MoSe2-Metal Contacts." The Journal of Physical Chemistry C (2016). +  - Pan, Yuanyuan, et al. "Interfacial Properties of Monolayer MoSe2-Metal Contacts." **The Journal of Physical Chemistry C** (2016). 
-  - Pan, Yuanyuan, et al. "Monolayer Phosphorene–Metal Contacts." Chemistry of Materials 28.7 (2016): 2100-2109. +  - Pan, Yuanyuan, et al. "Monolayer Phosphorene–Metal Contacts." **Chemistry of Materials** 28.7 (2016): 2100-2109. 
-  - Horsfield, Andrew P., et al. "Efficient simulations with electronic open boundaries." Physical Review B 94.7 (2016): 075118. +  - Horsfield, Andrew P., et al. "Efficient simulations with electronic open boundaries." **Physical Review B** 94.7 (2016): 075118. 
-  - Ekspong, Joakim, et al. "Stabilizing Active Edge Sites in Semicrystalline Molybdenum Sulfide by Anchorage on Nitrogen‐Doped Carbon Nanotubes for Hydrogen Evolution Reaction." Advanced Functional Materials (2016). +  - Ekspong, Joakim, et al. "Stabilizing Active Edge Sites in Semicrystalline Molybdenum Sulfide by Anchorage on Nitrogen‐Doped Carbon Nanotubes for Hydrogen Evolution Reaction." **Advanced Functional Materials** (2016). 
-  - de Oteyza, Dimas G., et al. "Non-Covalent Dimerization after Enediyne Cyclization on Au (111)." Journal of the American Chemical Society (2016). +  - de Oteyza, Dimas G., et al. "Non-Covalent Dimerization after Enediyne Cyclization on Au (111)." **Journal of the American Chemical Society** (2016). 
-  - Lisesivdin, Sefer Bora, Beyza Sarikavak-Lisesivdin, and Ekmel Ozbay. "15 Effects of the Interaction." Graphene Science Handbook: Electrical and Optical Properties (2016): 221. +  - Lisesivdin, Sefer Bora, Beyza Sarikavak-Lisesivdin, and Ekmel Ozbay. "15 Effects of the Interaction." **Graphene Science Handbook: Electrical and Optical Properties** (2016): 221. 
-  - Naskar, Barnali, et al. "Fluorescent sensing of Al 3+ by benzophenone based Schiff base chemosensor and live cell imaging applications: Impact of keto-enol tautomerism." Sensors and Actuators B: Chemical 239 (2017): 1194-1204. +  - Naskar, Barnali, et al. "Fluorescent sensing of Al 3+ by benzophenone based Schiff base chemosensor and live cell imaging applications: Impact of keto-enol tautomerism." **Sensors and Actuators B: Chemical** 239 (2017): 1194-1204. 
-  - Saha, Dipankar, and Santanu Mahapatra. "Atomistic modeling of the metallic-to-semiconducting phase boundaries in monolayer MoS2." Applied Physics Letters 108.25 (2016): 253106. +  - Saha, Dipankar, and Santanu Mahapatra. "Atomistic modeling of the metallic-to-semiconducting phase boundaries in monolayer MoS2." **Applied Physics Letters** 108.25 (2016): 253106. 
-  - Ray, S. J. "Gate engineered performance of single molecular transistor."Journal of Applied Physics 119.20 (2016): 204302.+  - Ray, S. J. "Gate engineered performance of single molecular transistor." **Journal of Applied Physics** 119.20 (2016): 204302.
   - Agarwal, Sarvesh, et al. "Metal Carbon Nanotube Schottky Barrier Diode with Detection of Polar Non-polar Gases." 2016 29th International Conference on VLSI Design and 2016 15th International Conference on Embedded Systems (VLSID). IEEE, 2016.   - Agarwal, Sarvesh, et al. "Metal Carbon Nanotube Schottky Barrier Diode with Detection of Polar Non-polar Gases." 2016 29th International Conference on VLSI Design and 2016 15th International Conference on Embedded Systems (VLSID). IEEE, 2016.
-  - Burzurí, Enrique, et al. "Sequential Electron Transport and Vibrational Excitations in an Organic Molecule Coupled to Few-Layer Graphene Electrodes." ACS nano 10.2 (2016): 2521-2527. +  - Burzurí, Enrique, et al. "Sequential Electron Transport and Vibrational Excitations in an Organic Molecule Coupled to Few-Layer Graphene Electrodes." **ACS nano** 10.2 (2016): 2521-2527. 
-  - Dutta, Tapas, et al. "Impact of Channel Thickness Variation on Bandstructure and Source-to-Drain Tunneling in Ultra-Thin Body III-V MOSFETs." IEEE Journal of the Electron Devices Society 4.2 (2016): 66-71. +  - Dutta, Tapas, et al. "Impact of Channel Thickness Variation on Bandstructure and Source-to-Drain Tunneling in Ultra-Thin Body III-V MOSFETs." **IEEE Journal of the Electron Devices Society** 4.2 (2016): 66-71. 
-  - Chanana, Anuja, and Santanu Mahapatra. "Density functional theory based study of chlorine doped WS2-metal interface." Applied Physics Letters108.10 (2016): 103107. +  - Chanana, Anuja, and Santanu Mahapatra. "Density functional theory based study of chlorine doped WS2-metal interface." **Applied Physics Letters** 108.10 (2016): 103107. 
-  - Chanana, Anuja, and Santanu Mahapatra. "Prospects of zero Schottky barrier height in a graphene-inserted MoS2-metal interface." Journal of Applied Physics 119.1 (2016): 014303. +  - Chanana, Anuja, and Santanu Mahapatra. "Prospects of zero Schottky barrier height in a graphene-inserted MoS2-metal interface." **Journal of Applied Physics** 119.1 (2016): 014303. 
-  - Saha, Dipankar, and Santanu Mahapatra. "Theoretical insights on the electro-thermal transport properties of monolayer MoS2 with line defects."Journal of Applied Physics 119.13 (2016): 134304. +  - Saha, Dipankar, and Santanu Mahapatra. "Theoretical insights on the electro-thermal transport properties of monolayer MoS2 with line defects." **Journal of Applied Physics** 119.13 (2016): 134304. 
-  - Stradi, Daniele, et al. "General atomistic approach for modeling metal-semiconductor interfaces using density functional theory and nonequilibrium Green's function." Physical Review B 93.15 (2016): 155302. +  - Stradi, Daniele, et al. "General atomistic approach for modeling metal-semiconductor interfaces using density functional theory and nonequilibrium Green's function." **Physical Review B** 93.15 (2016): 155302. 
-  - Chakrabarty, Aurab, et al. "Influence of surface vacancy defects on the carburisation of Fe 110 surface by carbon monoxide." The Journal of Chemical Physics 145.4 (2016): 044710. +  - Chakrabarty, Aurab, et al. "Influence of surface vacancy defects on the carburisation of Fe 110 surface by carbon monoxide." **The Journal of Chemical Physics** 145.4 (2016): 044710. 
-  - Al Balushi, Zakaria Y., et al. "Two-dimensional gallium nitride realized via graphene encapsulation." Nature Materials (2016).+  - Al Balushi, Zakaria Y., et al. "Two-dimensional gallium nitride realized via graphene encapsulation." **Nature Materials** (2016)
 +  - Fan Z Q, Zhang Z H, Deng X Q, et al. Effect of electrode twisting on electronic transport properties of atomic carbon wires[J]. **Carbon**, 2016, 98:179-186.
  
  
  
atk/vnl-atk_2016年发表文章列表.1474465017.txt.gz · 最后更改: 2016/09/21 21:36 由 dong.dong

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