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The Journal of Chemical Physics
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June 22, 2007
Real or artifactual symmetry breaking in the BNB radical: a multireference coupled cluster viewpoint
Xiangzhu Li, Josef Paldus
Physical Review. B, Condensed Matter
|
June 15, 1990
Exact Hartree-Fock exchange in one-dimensional metals. II
Jeziorska, Stolarczyk, Paldus, et al.
Physical Review. B, Condensed Matter
|
August 15, 1990
Coupled-cluster approaches with an approximate account of triexcitations and the optimized-inner-projection technique. II. Coupled-cluster results for cyclic-polyene model systems
Piecuch, Zarrabian, Paldus, et al.
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
The Journal of Chemical Physics
|
September 26, 2009
Accounting for the exact degeneracy and quasidegeneracy in the automerization of cyclobutadiene via multireference coupled-cluster methods
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
August 7, 2009
Computation of molecular vibrational frequencies using anomalous harmoniclike potentials
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
April 17, 2008
Partially linearized, fully size-extensive, and reduced multireference coupled-cluster methods. I. Formalism and mutual relationship
Xiangzhu Li, Josef Paldus
Page
of 8
Search research articles
Search
Showing results (11-20 of 77) with videos related to
Sort By:
Page
of 8
The Journal of Chemical Physics
|
June 22, 2007
Real or artifactual symmetry breaking in the BNB radical: a multireference coupled cluster viewpoint
Xiangzhu Li, Josef Paldus
Physical Review. B, Condensed Matter
|
June 15, 1990
Exact Hartree-Fock exchange in one-dimensional metals. II
Jeziorska, Stolarczyk, Paldus, et al.
Physical Review. B, Condensed Matter
|
August 15, 1990
Coupled-cluster approaches with an approximate account of triexcitations and the optimized-inner-projection technique. II. Coupled-cluster results for cyclic-polyene model systems
Piecuch, Zarrabian, Paldus, et al.
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
The Journal of Chemical Physics
|
September 26, 2009
Accounting for the exact degeneracy and quasidegeneracy in the automerization of cyclobutadiene via multireference coupled-cluster methods
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
August 7, 2009
Computation of molecular vibrational frequencies using anomalous harmoniclike potentials
Xiangzhu Li, Josef Paldus
The Journal of Chemical Physics
|
April 17, 2008
Partially linearized, fully size-extensive, and reduced multireference coupled-cluster methods. I. Formalism and mutual relationship
Xiangzhu Li, Josef Paldus
Page
of 8