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Physical Chemistry Chemical Physics : PCCP
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February 20, 2020
Elucidating the multi-configurational character of the firefly dioxetanone anion and its prototypes in the biradical region using full valence active spaces
Yingjin Ma
The Journal of Chemical Physics
|
December 13, 2012
Solvatochromic shifts of polar and non-polar molecules in ambient and supercritical water: a sequential quantum mechanics/molecular mechanics study including solute-solvent electron exchange-correlation
Haibo Ma, Yingjin Ma
The Journal of Physical Chemistry. A
|
April 19, 2013
Calculating excited states of molecular aggregates by the renormalized excitonic method
Yingjin Ma, Haibo Ma
The Journal of Chemical Physics
|
June 21, 2013
Assessment of various natural orbitals as the basis of large active space density-matrix renormalization group calculations
Yingjin Ma, Haibo Ma
The Journal of Chemical Physics
|
June 14, 2013
Response to "Comment on 'Solvatochromic shifts of polar and non-polar molecules in ambient and supercritical water: a sequential quantum mechanics/molecular mechanics study including solute-solvent electron exchange-correlation"' [J. Chem. Phys. 138, 217101 (2013)]
Haibo Ma, Yingjin Ma
The Journal of Chemical Physics
|
June 21, 2013
Solvent effect on electronic absorption, fluorescence, and phosphorescence of acetone in water: revisited by quantum mechanics/molecular mechanics (QM/MM) simulations
Haibo Ma, Yingjin Ma
Journal of Chemical Theory and Computation
|
July 17, 2020
Variational Multistate Density Functional Theory for a Balanced Treatment of Static and Dynamic Correlations
Zexing Qu, Yingjin Ma
The Journal of Chemical Physics
|
July 24, 2015
Density-matrix renormalization group algorithm with multi-level active space
Yingjin Ma, Jing Wen, Haibo Ma
The Journal of Chemical Physics
|
January 21, 2012
A new fragment-based approach for calculating electronic excitation energies of large systems
Yingjin Ma, Yang Liu, Haibo Ma
Journal of Chemical Theory and Computation
|
August 27, 2020
Correction to Variational Multistate Density Functional Theory for a Balanced Treatment of Static and Dynamic Correlations
Zexing Qu, Yingjin Ma, Jiali Gao
Page
of 4
Search research articles
Search
Showing results (1-10 of 34) with videos related to
Sort By:
Page
of 4
Physical Chemistry Chemical Physics : PCCP
|
February 20, 2020
Elucidating the multi-configurational character of the firefly dioxetanone anion and its prototypes in the biradical region using full valence active spaces
Yingjin Ma
The Journal of Chemical Physics
|
December 13, 2012
Solvatochromic shifts of polar and non-polar molecules in ambient and supercritical water: a sequential quantum mechanics/molecular mechanics study including solute-solvent electron exchange-correlation
Haibo Ma, Yingjin Ma
The Journal of Physical Chemistry. A
|
April 19, 2013
Calculating excited states of molecular aggregates by the renormalized excitonic method
Yingjin Ma, Haibo Ma
The Journal of Chemical Physics
|
June 21, 2013
Assessment of various natural orbitals as the basis of large active space density-matrix renormalization group calculations
Yingjin Ma, Haibo Ma
The Journal of Chemical Physics
|
June 14, 2013
Response to "Comment on 'Solvatochromic shifts of polar and non-polar molecules in ambient and supercritical water: a sequential quantum mechanics/molecular mechanics study including solute-solvent electron exchange-correlation"' [J. Chem. Phys. 138, 217101 (2013)]
Haibo Ma, Yingjin Ma
The Journal of Chemical Physics
|
June 21, 2013
Solvent effect on electronic absorption, fluorescence, and phosphorescence of acetone in water: revisited by quantum mechanics/molecular mechanics (QM/MM) simulations
Haibo Ma, Yingjin Ma
Journal of Chemical Theory and Computation
|
July 17, 2020
Variational Multistate Density Functional Theory for a Balanced Treatment of Static and Dynamic Correlations
Zexing Qu, Yingjin Ma
The Journal of Chemical Physics
|
July 24, 2015
Density-matrix renormalization group algorithm with multi-level active space
Yingjin Ma, Jing Wen, Haibo Ma
The Journal of Chemical Physics
|
January 21, 2012
A new fragment-based approach for calculating electronic excitation energies of large systems
Yingjin Ma, Yang Liu, Haibo Ma
Journal of Chemical Theory and Computation
|
August 27, 2020
Correction to Variational Multistate Density Functional Theory for a Balanced Treatment of Static and Dynamic Correlations
Zexing Qu, Yingjin Ma, Jiali Gao
Page
of 4