上级目录

荧光/紫外可见光谱/吸收光谱/激发态[目录]

  1. 【赵纪军教授课题组】巯基保护金纳米团簇的核心堆积相关振动性质及其激发态行为, Inorg. Chem., 2023, DOI: 10.1021/acs.inorgchem.3c03482
  2. 基于双子方法的聚苯胺结构与激发态性质的关系, RSC Adv., 2023, 13, 27898-27911, DOI:10.1039/D3RA05621J
  3. 【国内课题组】Unraveling the Marked Differences of the Excited-State Properties of Arylgold(III) Complexes with C∧N∧C Tridentate Ligands(Inorg. Chem. 2023)
  4. 三齿Schiff碱配体负载的四核和六核锌配合物的合成、结构和光物理性质, Chemistry 2023, 5, 1028–1045
  5. 具有内部电场的超原子分子用于光收集 (Nanoscale 2020)
  6. 羰基铁配合物的高分辨X射线吸收光谱(2015)
  7. 银、金纳米颗粒的光学性质(2014)
  8. 银与金纳米颗粒的光学性质(JACS两篇，2014)
  9. 元结异构体(Agostic Isomers)-不同的颜色和结构(Angew. Chem. Int. Ed.，2013)
  10. 双核金属自由基成键(Angew. Chem. Int. Ed.，2012)
  11. 双钌催化剂的钌L2,3边沿的XANES谱(JACS，2011)
  12. 锂-氨溶液在分子水平的模型(Angew. Chem. Int. Ed.，2009)
  13. 龙虾煮熟为啥变红？(JACS，2005)

其他

2024

  1. 钌配合物中卤素对自旋禁止跃迁和近红外吸收的影响, Chemical Physics Letters, 2024, Available online 26 April 2024, 141295, DOI: 10.1016/j.cplett.2024.141295
  2. 具有不同锚定基团的Ni和Zn金属卟啉的结构、电子和光谱性质的计算研究, The Journal of Chemical Physics, 2024, DOI: 10.1063/5.0191858
  3. 用DIM/QM方法模拟分子激发态的近场效应, J. Chem. Phys.,2024, 160, 014707

2023

  1. EXCITED STATE DYNAMICS AND CHEMICAL BOND REARRANGEMENT IN RUTHENIUM NITROSYL COMPLEXES AND SEVERAL OTHER HEAVY-ATOMCONTAINING COMPOUNDS,博士论文
  2. 气相中阿司匹林、对乙酰氨基酚和布洛芬的光电子能谱研究, Phys. Chem. Chem. Phys., 2023, DOI: 10.1039/d2cp05810c
  3. 对有机含硫体系在高位单态激发态下的单态裂变的探索——反卡沙规则的应用前景, Phys. Chem. Chem. Phys., 2023, DOI: 10.1039/D3CP00298E
  4. 喹啉并[3,2-b]苯二氮卓和喹啉并[3,2-b]苯并恶嗪金属过渡金属M(L)2Cl2和M(L)Cl2配合物的分子和电子结构、键分析和UV-Vis光谱预测(Structural Chemistry 2023)
  5. 两种新型对称叠氮席夫碱的合成、光谱、晶体、DFT、分子对接和体外胆碱酯酶抑制评价(Journal of Molecular Structure 2023)
  6. 同/异相铒（III）苯胺基二维配位聚合物发光性质的实验/理论联合研究(HAL open science 2023)

2022

  1. TiSiO4团簇光学性质的TD-DFT研究(Optical and Quantum Electronics 2022)
  2. 吡啶席夫碱分子内氢键作为Re（I）配合物的辅助配体是可见光和近红外发射之间的开关：相对论量子化学研究(J. Phys. Chem. A 2022)
  3. Coupling between Plasmonic and Molecular Excitations: TDDFT Investigation of an Ag-Nanorod/BODIPY–Dye Interaction(J. Phys. Chem. A 2022)
  4. 六钼簇[Mo6Cl14]2–用于感应硝基芳香化合物(ACS Omega 2022)
  5. 四面体铝纳米颗粒光学性质的含时密度泛函理论研究(Journal of Computational Chemistry 2022)

2021

  1. 捕光复合物的结构和光谱性质之间的关系(J. Phys. Chem. A 2021)
  2. 苯并咪唑和环庚咪唑金氮杂环卡宾的结构与电子性质( E Schott - Polyhedron 2021)

2020

  1. 纳米银颗粒均二聚体和异二聚体光学性质的TD-DFTB研究(J. Chem. Phys. 2020)
  2. Eu(III)MOF对苯胺选择性的传感机理解析：多构象理论计算(J. Comput. Chem. 2020)
  3. Excited-State Switching Frustrates the Tuning of Properties in Triphenylamine-Donor-Ligand Rhenium(I) and Platinum(II) Complexes(Inorg. Chem. 2020)
  4. Experimental and Theoretical Photoemission Study of Indole and Its Derivatives in the Gas Phase(J. Phys. Chem. A 2020)
  5. Synthesis, Structures, and Photoluminescent Properties of Tricyanidonitridorhenium(V) Complexes with Bipyridine-Type Ligands(Inorg. Chem. 2020)
  6. Synthesis, spectroscopic characterization, crystal structure, DFT studies and biological activities of new hydrazone derivative: 1-(2,5-bis((E)-4-isopropylbenzylidene)cyclopentylidene)-2-(2,4-dinitrophenyl) hydrazine(Journal of Molecular Structure 2020)
  7. Electronic excited states and luminescence properties of palladium (II) corrin complex (Journal of Photochemistry and Photobiology A: Chemistry 2019)