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Journal Articles

Coordinate bond breaking induced by collapse of poly(N-isopropyl acrylamide) as ligands of a rare Earth complex

Tian-yu Song, Yan-yang Zhu, Shuo-feng Liang, Gang Zou, Qi-jin Zhang
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 31, 677–683 (2018)
https://doi.org/10.1063/1674-0068/31/cjcp1804059
Published: October 2018
View article titled, Coordinate bond breaking induced by collapse of poly(<em>N</em>-isopropyl acrylamide) as ligands of a rare Earth complex
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Journal Articles

Intraparticle charge delocalization through conjugated metal-ligand interfacial bonds: Effects of metal d electrons

Yi Peng, Eduardo Y. Hirata, Wanzhang Pan, Limei Chen, Jia En Lu, Shaowei Chen
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 31, 433–438 (2018)
https://doi.org/10.1063/1674-0068/31/cjcp1804073
Published: August 2018
View article titled, Intraparticle charge delocalization through conjugated metal-ligand interfacial bonds: Effects of metal d electrons
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Journal Articles

Oxygen Electroreduction Performance of Ultrasmall Gold Nanoclusters

Ting Huang, Zhi-hu Sun, Guo-qiang Pan
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 31, 66–70 (2018)
https://doi.org/10.1063/1674-0068/31/cjcp1707134
Published: February 2018
View article titled, Oxygen Electroreduction Performance of Ultrasmall Gold Nanoclusters
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Journal Articles

Infrared Spectra, Structures and Bonding of Binuclear Transition Metal Carbonyl Cluster Ions

Guan-jun Wang, Ming-fei Zhou
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 31, 1–11 (2018)
https://doi.org/10.1063/1674-0068/31/cjcp1710192
Published: February 2018
View article titled, Infrared Spectra, Structures and Bonding of Binuclear Transition Metal Carbonyl Cluster Ions
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Journal Articles

Comparison of Accuracy and Convergence Rate between Equilibrium and Nonequilibrium Alchemical Transformations for Calculation of Relative Binding Free Energy

Peng-fei Li, Xiang-yu Jia, Mei-ting Wang, Ye Mei
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 30, 789–799 (2017)
https://doi.org/10.1063/1674-0068/30/cjcp1711204
Published: December 2017
View article titled, Comparison of Accuracy and Convergence Rate between Equilibrium and Nonequilibrium Alchemical Transformations for Calculation of Relative Binding Free Energy
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Journal Articles

Binding Mechanism and Molecular Design of Benzimidazole/Benzothiazole Derivatives as Potent Abl T315I Mutant Inhibitors

Wei-cong Lin, She-pei Tan, Sheng-fu Zhou, Xiao-jie Zheng, Wen-juan Wu, Kang-cheng Zheng
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 30, 429–442 (2017)
https://doi.org/10.1063/1674-0068/30/cjcp1704066
Published: August 2017
View article titled, Binding Mechanism and Molecular Design of Benzimidazole/Benzothiazole Derivatives as Potent Abl T315I Mutant Inhibitors
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Journal Articles

Effects of Oxygen Vacancy on the Adsorption of Formaldehyde on Rutile TiO2(110) Surface

Li-ming Liu, Jin Zhao
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 30, 312–318 (2017)
https://doi.org/10.1063/1674-0068/30/cjcp1703049
Published: June 2017
View article titled, Effects of Oxygen Vacancy on the Adsorption of Formaldehyde on Rutile TiO<sub>2</sub>(110) Surface
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Journal Articles

Phosphorescent Cationic Iridium(III) Complexes with 1,3,4-Oxadiazole Cyclometalating Ligands: Solvent-Dependent Excited-State Dynamics

Zhuoran Kuang, Xian Wang, Zhen Wang, Guiying He, Qianjin Guo, Lei He, Andong Xia
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 30, 259–267 (2017)
https://doi.org/10.1063/1674-0068/30/cjcp1703058
Published: June 2017
View article titled, Phosphorescent Cationic Iridium(III) Complexes with 1,3,4-Oxadiazole Cyclometalating Ligands: Solvent-Dependent Excited-State Dynamics
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Journal Articles

Superselective Adsorption of Multivalent Polymer Chains to a Surface with Receptors

Hao-zhi Huang, Yu-hao Chen, Wan-cheng Yu, Kai-fu Luo
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 29, 564–570 (2016)
https://doi.org/10.1063/1674-0068/29/cjcp1603060
Published: October 2016
View article titled, Superselective Adsorption of Multivalent Polymer Chains to a Surface with Receptors
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Journal Articles

Construction and Evaluation of Merged Pharmacophore Based on Peroxisome Proliferator Receptor-Alpha Agonists

Lian-sheng Qiao, Yu-su He, Xiao-qian Huo, Lu-di Jiang, Yan-kun Chen, Xi Chen, Yan-ling Zhang, Gong-yu Li
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 29, 508–516 (2016)
https://doi.org/10.1063/1674-0068/29/cjcp1602025
Published: August 2016
View article titled, Construction and Evaluation of Merged Pharmacophore Based on Peroxisome Proliferator Receptor-Alpha Agonists
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Journal Articles

SP3-Hybridization Feature of Ag4 Superatom in Superatomic Molecules

Li-juan Yan, Long-jiu Cheng, Jin-long Yang
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 28, 476–480 (2015)
https://doi.org/10.1063/1674-0068/28/cjcp1505105
Published: August 2015
View article titled, SP<sup>3</sup>-Hybridization Feature of Ag<sub>4</sub> Superatom in Superatomic Molecules
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Journal Articles

Density Functional Theory Calculations on Ni—Ligand Bond Dissociation Enthalpies

Bing Wang, Yao Fu, Hai-zhu Yu, Jing Shi
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 27, 640–646 (2014)
https://doi.org/10.1063/1674-0068/27/06/640-646
Published: December 2014
View article titled, Density Functional Theory Calculations on Ni—Ligand Bond Dissociation Enthalpies
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Journal Articles

Microwave Assisted Synthesis of a New Triplet Iridium(III) Pyrazine Complex

Qiu-hua Wu, Chuan-hong Wang, Xi-ming Song, Guo-lin Zhang
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 23, 355–357 (2010)
https://doi.org/10.1088/1674-0068/23/03/355-357
Published: June 2010
View article titled, Microwave Assisted Synthesis of a New Triplet Iridium(III) Pyrazine Complex
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Journal Articles

Ligand Size Effect on PdLn Oxidative Addition with Aryl Bromide: A DFT Study

Wen-jing Sun, Wei Chu, Liang-jun Yu, Cheng-fa Jiang
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 23, 175–179 (2010)
https://doi.org/10.1088/1674-0068/23/02/175-179
Published: April 2010
View article titled, Ligand Size Effect on PdL<sub><em>n</em></sub> Oxidative Addition with Aryl Bromide: A DFT Study
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Journal Articles

Visualization of Metal-to-Ligand and Ligand-to-Ligand Charge Transfer in Metal-Ligand Complexes

Yong Ding, Jian-xiu Guo, Xiang-si Wang, Sha-sha Liu, Feng-cai Ma
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 22, 269–274 (2009)
https://doi.org/10.1088/1674-0068/22/03/269-274
Published: June 2009
View article titled, Visualization of Metal-to-Ligand and Ligand-to-Ligand Charge Transfer in Metal-Ligand Complexes
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Journal Articles

Influence of Chemical Effect on the K/K Intensity Ratios and K Energy Shift of Co, Ni, Cu, and Zn Complexes

G. Apaydn, V. Aylk, Z. Byklolu, E. Tralu, H. Kantekin
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 21, 591–595 (2008)
https://doi.org/10.1088/1674-0068/21/06/591-595
Published: December 2008
View article titled, Influence of Chemical Effect on the K/K Intensity Ratios and K Energy Shift of Co, Ni, Cu, and Zn Complexes
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Journal Articles

Hydrolysis of New Transplatin Analogue Containing One Aliphatic and One Planar Heterocyclic Amine Ligand: A Density Functional Theory Study

Yan Gao, Li-xin Zhou
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 21, 346–352 (2008)
https://doi.org/10.1088/1674-0068/21/04/346-352
Published: August 2008
View article titled, Hydrolysis of New Transplatin Analogue Containing One Aliphatic and One Planar Heterocyclic Amine Ligand: A Density Functional Theory Study
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Journal Articles

Photoacoustic and Fluorescence Spectroscopy of Metallomesogens Containing Lanthanide Ions

Yue-tao Yang, Jun-jia Li, Xiao-jun Liu, Shu-yi Zhang, Jing Liu
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 21, 99–104 (2008)
https://doi.org/10.1088/1674-0068/21/02/99-104
Published: April 2008
View article titled, Photoacoustic and Fluorescence Spectroscopy of Metallomesogens Containing Lanthanide Ions
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Journal Articles

Determination of Stability Constants of Cadmium-Glycine Complexes by a Unified Treatment for Potentiometric and Polarographic Data

Jian-min Zhang, Qiu-zhi Shi
Journal: Chinese Journal of Chemical Physics
Chin. J. Chem. Phys. 19, 164–168 (2006)
https://doi.org/10.1360/cjcp2006.19(2).164.5
Published: August 2006
View article titled, Determination of Stability Constants of Cadmium-Glycine Complexes by a Unified Treatment for Potentiometric and Polarographic Data
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