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The Journal of Chemical Physics
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January 28, 2006
General-model-space state-universal coupled-cluster methods for excited states: diagonal noniterative triple corrections
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
May 2, 2009
Analysis and classification of symmetry breaking in linear ABA-type triatomics
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
March 5, 2009
Do independent-particle-model broken-symmetry solutions contain more physics than the symmetry-adapted ones? The case of homonuclear diatomics
Xiangzhu Li, Josef Paldus
The Journal of Physical Chemistry. A
|
February 17, 2010
A multireference coupled-cluster study of electronic excitations in furan and pyrrole
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
July 17, 2010
Performance of multireference and equation-of-motion coupled-cluster methods for potential energy surfaces of low-lying excited states: symmetric and asymmetric dissociation of water
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
November 10, 2006
A truncated version of reduced multireference coupled-cluster method with singles and doubles and noniterative triples: application to F2 and Ni(CO)n (n=1, 2, and 4)
Xiangzhu Li, Josef Paldus
The Journal of Physical Chemistry. A
|
April 19, 2007
Reduced multireference coupled-cluster method: barrier heights for heavy atom transfer, nucleophilic substitution, association, and unimolecular reactions
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
August 14, 2008
Full potential energy curve for N2 by the reduced multireference coupled-cluster method
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
March 25, 2010
Force field of para- and metabenzyne diradicals: a multireference coupled-cluster study
Xiangzhu Li, Josef Paldus
Physical Chemistry Chemical Physics : PCCP
|
June 25, 2009
Symmetry breaking in spin-restricted Hartree-Fock solutions: the case of the C2 molecule and the N(2)+ and F(2)+ cations
Xiangzhu Li, Josef Paldus
Page
of 4
Search research articles
Search
Showing results (11-20 of 39) with videos related to
Sort By:
Page
of 4
The Journal of Chemical Physics
|
January 28, 2006
General-model-space state-universal coupled-cluster methods for excited states: diagonal noniterative triple corrections
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
May 2, 2009
Analysis and classification of symmetry breaking in linear ABA-type triatomics
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
March 5, 2009
Do independent-particle-model broken-symmetry solutions contain more physics than the symmetry-adapted ones? The case of homonuclear diatomics
Xiangzhu Li, Josef Paldus
The Journal of Physical Chemistry. A
|
February 17, 2010
A multireference coupled-cluster study of electronic excitations in furan and pyrrole
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
July 17, 2010
Performance of multireference and equation-of-motion coupled-cluster methods for potential energy surfaces of low-lying excited states: symmetric and asymmetric dissociation of water
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
November 10, 2006
A truncated version of reduced multireference coupled-cluster method with singles and doubles and noniterative triples: application to F2 and Ni(CO)n (n=1, 2, and 4)
Xiangzhu Li, Josef Paldus
The Journal of Physical Chemistry. A
|
April 19, 2007
Reduced multireference coupled-cluster method: barrier heights for heavy atom transfer, nucleophilic substitution, association, and unimolecular reactions
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
August 14, 2008
Full potential energy curve for N2 by the reduced multireference coupled-cluster method
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
March 25, 2010
Force field of para- and metabenzyne diradicals: a multireference coupled-cluster study
Xiangzhu Li, Josef Paldus
Physical Chemistry Chemical Physics : PCCP
|
June 25, 2009
Symmetry breaking in spin-restricted Hartree-Fock solutions: the case of the C2 molecule and the N(2)+ and F(2)+ cations
Xiangzhu Li, Josef Paldus
Page
of 4