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| adf:sers-ters [2020/05/29 09:42] – [红外IR、（共振）拉曼、表面/尖端增强拉曼SERS/TERS[目录]] liu.jun | adf:sers-ters [2023/07/25 22:06] (当前版本) – liu.jun |
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| | [[adf:publishedpapers|上级目录]] |
| ======红外、（共振）拉曼、表面/尖端增强拉曼SERS/TERS[目录]====== | ======红外、（共振）拉曼、表面/尖端增强拉曼SERS/TERS[目录]====== |
| * [[https://www.sciencedirect.com/science/article/abs/pii/S002228602030822X|Matrix isolation studies of vibrational structure of hemiporphycene(Journal of Molecular Structure 2020)]] | - QM/Classical Modeling of Surface Enhanced Raman Scattering Based on Atomistic Electromagnetic Models, J. Chem. Theory Comput. 2023, DOI: [[https://pubs.acs.org/doi/full/10.1021/acs.jctc.3c00177|10.1021/acs.jctc.3c00177]] |
| * [[https://www.sciencedirect.com/science/article/pii/S0927025619305075|A first-principles DFT dispersion-corrected C60/Au(111) Raman study (Computational Materials Science, 2020)]] | - [[https://doi.org/10.1063/5.0124553|使用扩展系统的拉曼键模型了解表面增强拉曼散射的化学增强(J. Chem. Phys. 2022)]] |
| * [[https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b00371|Adsorption of Mono- and Divalent 4-(Dimethylamino)pyridines on Gold Surfaces: Studies by Surface-Enhanced Raman Scattering and Density Functional Theory (Langmuir, 2019)]] | - [[https://pubs.rsc.org/en/content/articlepdf/2022/cp/d1cp04708f|金属团簇中的类分子和晶格振动(Physical Chemistry Chemical Physics 2022)]] |
| * [[https://www.fermitech.com.cn/news/adfhighlight-201910/|高分辨尖端增强拉曼散射图像解析分子结构的理论研究(ACS Nano, 2019; Nat. Commun. 2019)]] | - [[https://onlinelibrary.wiley.com/doi/pdf/10.1002/smll.202101855|原子精度配体保护贵金属簇Au38(PET)24和Au38−xAgx(PET)24的拉曼光谱指纹(Small 2021)]] |
| * [[https://onlinelibrary.wiley.com/doi/abs/10.1002/jrs.5782|Revisiting the conformational adsorption of L‐ and D‐cysteine on Au nanoparticles by Raman spectroscopy(Journal of Raman Spectroscopy 2019)]] | - [[https://aip.scitation.org/doi/full/10.1063/5.0051256|溶液中表面增强拉曼光谱的离散相互作用模型/量子力学模拟方法(DIM/QM)(J. Chem. Phys. 2021)]] |
| * [[https://pubs.acs.org/doi/abs/10.1021/acsami.9b11892|Measuring Local Electric Fields and Local Charge Densities at Electrode Surfaces using Graphene-enhanced Raman Spectroscopy (GERS)-based Stark-shifts, ACS Appl. Mater. Interfaces, 2019]] | - [[https://pubs.acs.org/doi/abs/10.1021/acs.iecr.1c00852|Raman and DFT Study of the H2S Scavenger Reaction of HET-TRZ under Simulated Contactor Tower Conditions(Ind. Eng. Chem. Res. 2021)]] |
| * [[https://pubs.rsc.org/en/content/articlelanding/2019/me/c9me00032a/unauth#!divAbstract|Optimizing linear polymer affinity agent properties for surface-enhanced Raman scattering detection of aflatoxin B1(Molecular Systems Design & Engineering, 2019)]] | - [[https://pubs.acs.org/doi/abs/10.1021/acs.jpcb.0c10576|Effects of Conformational Variation on Structural Insights from Solution-Phase Surface-Enhanced Raman Spectroscopy(J. Phys. Chem. B 2021)]] |
| * [[https://pubs.acs.org/doi/abs/10.1021/acs.analchem.9b00773|Physicochemical Trapping of Neurotransmitters in Polymer-mediated Gold Nanoparticle Aggregates for Surface-enhanced Raman Spectroscopy(Analytical Chemistry, 2019)]] | - [[https://onlinelibrary.wiley.com/doi/abs/10.1002/jrs.6027|Surface‐enhanced resonance Raman detection of 1,1‐diamino‐2,2‐dinitroethylene (FOX‐7) on metal‐doped Au12 and Ag12 clusters(Journal of Raman Spectroscopy 2020)]] |
| * [[https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b00371|Adsorption of Mono- and Divalent 4-(Dimethylamino)pyridines on Gold Surfaces: Studies by Surface-Enhanced Raman Scattering and Density Functional Theory (Langmuir, 2019)]] | - [[https://aip.scitation.org/doi/full/10.1063/5.0023359|理解SERS增强机制的化学贡献：与Hammett参数的联系(The Journal of Chemical Physics 2020)]] |
| * [[http://www.fermitech.com.cn/adf-highlight-008|DIM/QM模拟表面增强拉曼光学活性(2014)]] | - [[https://www.sciencedirect.com/science/article/abs/pii/S0167732219371971|镧系配合物在膦基离子液体中溶剂化结构和热力学的拉曼光谱和密度泛函理论研究(Journal of Molecular Liquids 2020)]] |
| ======红外====== | - [[https://www.sciencedirect.com/science/article/pii/S0924203120301181|Detection of decomposition products of C4F7N-CO2 gas mixture based on infrared spectroscopy(Vibrational Spectroscopy 2020)]] |
| * [[https://pubs.acs.org/doi/full/10.1021/acsomega.9b04421|DFT-Calculated IR Spectrum Amide I, II, and III Band Contributions of N-Methylacetamide Fine Components(ACS Omega 2020)]] | - [[https://pubs.acs.org/doi/full/10.1021/acsomega.9b04421|DFT-Calculated IR Spectrum Amide I, II, and III Band Contributions of N-Methylacetamide Fine Components(ACS Omega 2020)]] |
| | - [[https://www.sciencedirect.com/science/article/abs/pii/S002228602030822X|Matrix isolation studies of vibrational structure of hemiporphycene(Journal of Molecular Structure 2020)]] |
| | - [[https://www.sciencedirect.com/science/article/pii/S0927025619305075|A first-principles DFT dispersion-corrected C60/Au(111) Raman study (Computational Materials Science, 2020)]] |
| | - [[https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b00371|Adsorption of Mono- and Divalent 4-(Dimethylamino)pyridines on Gold Surfaces: Studies by Surface-Enhanced Raman Scattering and Density Functional Theory (Langmuir, 2019)]] |
| | - [[https://www.fermitech.com.cn/news/adfhighlight-201910/|高分辨尖端增强拉曼散射图像解析分子结构的理论研究(ACS Nano, 2019; Nat. Commun. 2019)]] |
| | - [[https://onlinelibrary.wiley.com/doi/abs/10.1002/jrs.5782|Revisiting the conformational adsorption of L‐ and D‐cysteine on Au nanoparticles by Raman spectroscopy(Journal of Raman Spectroscopy 2019)]] |
| | - [[https://pubs.acs.org/doi/abs/10.1021/acsami.9b11892|Measuring Local Electric Fields and Local Charge Densities at Electrode Surfaces using Graphene-enhanced Raman Spectroscopy (GERS)-based Stark-shifts, ACS Appl. Mater. Interfaces, 2019]] |
| | - [[https://pubs.rsc.org/en/content/articlelanding/2019/me/c9me00032a/unauth#!divAbstract|Optimizing linear polymer affinity agent properties for surface-enhanced Raman scattering detection of aflatoxin B1(Molecular Systems Design & Engineering, 2019)]] |
| | - [[https://pubs.acs.org/doi/abs/10.1021/acs.analchem.9b00773|Physicochemical Trapping of Neurotransmitters in Polymer-mediated Gold Nanoparticle Aggregates for Surface-enhanced Raman Spectroscopy(Analytical Chemistry, 2019)]] |
| | - [[https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b00371|Adsorption of Mono- and Divalent 4-(Dimethylamino)pyridines on Gold Surfaces: Studies by Surface-Enhanced Raman Scattering and Density Functional Theory (Langmuir, 2019)]] |
| | - [[http://www.fermitech.com.cn/adf-highlight-008|DIM/QM模拟表面增强拉曼光学活性(2014)]] |
