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Wiley电子期刊(3)
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ACS电子期刊(74)
SpringerLink电子期刊(5)
Elsevier电子期刊(17)
在“
ACS电子期刊
”中,
命中:
74
条,耗时:小于0.01 秒
在所有数据库中总计命中:
100
条
1.
Flexibility Coexists with Shape-Persistence in Cyanostar Macrocycles
作者:
Yun Liu
;
Abhishek Singharoy
;
Christopher G. Mayne
;
Arkajyoti Sengupta
;
Krishnan
Raghavachari
;
Klaus Schulten
;
Amar H. Flood
刊名:Journal of the American Chemical Society
出版年:2016
2.
Raman Optical Activity Spectra for Large Molecules through Molecules-in-Molecules Fragment-Based Approach
作者:
K. V. Jovan Jose
;
Krishnan
Raghavachari
刊名:Journal of Chemical Theory and Computation
出版年:2016
3.
H2S Reactivity on Oxygen-Deficient Heterotrimetallic Cores: Cluster Fluxionality Simulates Dynamic Aspects of Surface Chemical Reactions
作者:
Debashis Adhikari
;
Krishnan
Raghavachari
刊名:Journal of Physical Chemistry A
出版年:2016
4.
Restricted-Open-Shell G4(MP2)-Type Procedures
作者:
Bun Chan
;
Amir Karton
;
Krishnan
Raghavachari
;
Leo Radom
刊名:Journal of Physical Chemistry A
出版年:2016
5.
A Model for the pH-Dependent Selectivity of the Oxygen Reduction Reaction Electrocatalyzed by N-Doped Graphitic Carbon
作者:
Benjamin W. Noffke
;
Qiqi Li
;
Krishnan
Raghavachari
;
Liang-shi Li
刊名:Journal of the American Chemical Society
出版年:2016
6.
Basal Plane Fluorination of Graphene by XeF2 via a Radical Cation Mechanism
作者:
Yijun Liu
;
Benjamin W. Noffke
;
Xiaoxiao Qiao
;
Qiqi Li
;
Xinfeng Gao
;
Krishnan
Raghavachari
;
Liang-shi Li
刊名:The Journal of Physical Chemistry Letters
出版年:2015
7.
Vibrational Circular Dichroism Spectra for Large Molecules through Molecules-in-Molecules Fragment-Based Approach
作者:
K. V. Jovan Jose
;
Daniel Beckett
;
Krishnan
Raghavachari
刊名:Journal of Chemical Theory and Computation
出版年:2015
8.
Electrostatic and Allosteric Cooperativity in Ion-Pair Binding: A Quantitative and Coupled Experiment鈥揟heory Study with Aryl鈥揟riazole鈥揈ther Macrocycles
作者:
Bo Qiao
;
Arkajyoti Sengupta
;
Yun Liu
;
Kevin P. McDonald
;
Maren Pink
;
Joseph R. Anderson
;
Krishnan
Raghavachari
;
Amar H. Flood
刊名:Journal of the American Chemical Society
出版年:2015
9.
Evaluation of Energy Gradients and Infrared Vibrational Spectra through Molecules-in-Molecules Fragment-Based Approach
作者:
K. V. Jovan Jose
;
Krishnan
Raghavachari
刊名:Journal of Chemical Theory and Computation
出版年:2015
10.
Accurate Composite and Fragment-Based Quantum Chemical Models for Large Molecules
作者:
Krishnan
Raghavachari
;
Arjun Saha
刊名:Chemical Reviews
出版年:2015
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