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The Journal of Chemical Physics
|
September 27, 2006
Parallel algorithm for the computation of the Hartree-Fock exchange matrix: gas phase and periodic parallel ONX
Valéry Weber, Matt Challacombe
The Journal of Chemical Physics
|
August 5, 2004
The quasi-independent curvilinear coordinate approximation for geometry optimization
Károly Németh, Matt Challacombe
The Journal of Chemical Physics
|
March 25, 2014
Communication: An N-body solution to the problem of Fock exchange
Matt Challacombe, Nicolas Bock
The Journal of Chemical Physics
|
December 3, 2005
Geometry optimization of crystals by the quasi-independent curvilinear coordinate approximation
Károly Németh, Matt Challacombe
The Journal of Chemical Physics
|
April 26, 2005
Linear scaling computation of the Fock matrix. VII. Periodic density functional theory at the Gamma point
C J Tymczak, Matt Challacombe
The Journal of Chemical Physics
|
June 16, 2006
Exchange energy gradients with respect to atomic positions and cell parameters within the Hartree-Fock Gamma-point approximation
Valéry Weber, Claude Daul, Matt Challacombe
Physical Review Letters
|
June 1, 2004
Density matrix perturbation theory
Anders M N Niklasson, Matt Challacombe
Journal of Computational Chemistry
|
January 21, 2010
The choice of internal coordinates in complex chemical systems
Károly Németh, Matt Challacombe, Michel Van Veenendaal
The Journal of Chemical Physics
|
June 21, 2006
Energy gradients with respect to atomic positions and cell parameters for the Kohn-Sham density-functional theory at the Gamma point
Valéry Weber, Christopher J Tymczak, Matt Challacombe
The Journal of Chemical Physics
|
August 13, 2005
Nonorthogonal density-matrix perturbation theory
Anders M N Niklasson, Valéry Weber, Matt Challacombe
Page
of 3
Search research articles
Search
Showing results (1-10 of 21) with videos related to
Sort By:
Page
of 3
The Journal of Chemical Physics
|
September 27, 2006
Parallel algorithm for the computation of the Hartree-Fock exchange matrix: gas phase and periodic parallel ONX
Valéry Weber, Matt Challacombe
The Journal of Chemical Physics
|
August 5, 2004
The quasi-independent curvilinear coordinate approximation for geometry optimization
Károly Németh, Matt Challacombe
The Journal of Chemical Physics
|
March 25, 2014
Communication: An N-body solution to the problem of Fock exchange
Matt Challacombe, Nicolas Bock
The Journal of Chemical Physics
|
December 3, 2005
Geometry optimization of crystals by the quasi-independent curvilinear coordinate approximation
Károly Németh, Matt Challacombe
The Journal of Chemical Physics
|
April 26, 2005
Linear scaling computation of the Fock matrix. VII. Periodic density functional theory at the Gamma point
C J Tymczak, Matt Challacombe
The Journal of Chemical Physics
|
June 16, 2006
Exchange energy gradients with respect to atomic positions and cell parameters within the Hartree-Fock Gamma-point approximation
Valéry Weber, Claude Daul, Matt Challacombe
Physical Review Letters
|
June 1, 2004
Density matrix perturbation theory
Anders M N Niklasson, Matt Challacombe
Journal of Computational Chemistry
|
January 21, 2010
The choice of internal coordinates in complex chemical systems
Károly Németh, Matt Challacombe, Michel Van Veenendaal
The Journal of Chemical Physics
|
June 21, 2006
Energy gradients with respect to atomic positions and cell parameters for the Kohn-Sham density-functional theory at the Gamma point
Valéry Weber, Christopher J Tymczak, Matt Challacombe
The Journal of Chemical Physics
|
August 13, 2005
Nonorthogonal density-matrix perturbation theory
Anders M N Niklasson, Valéry Weber, Matt Challacombe
Page
of 3