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M

Matt Challacombe

Argonne National Laboratory

26H指数
68论文数
2.8K被引数
收录论文 31
发表时间
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Communication: An N-body solution to the problem of Fock exchange
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2014-03-19
err2
errOAAI
errChallacombe, Matt; Bock, Nicolas
err分享
err收藏
AN OPTIMIZED SPARSE APPROXIMATE MATRIX MULTIPLY FOR MATRICES WITH DECAY
errSIAM JOURNAL ON SCIENTIFIC COMPUTING
IF2.6
err2013-01-01
err25
errOAAI
errBock, Nicolas; Challacombe, Matt
err分享
err收藏
Trace correcting density matrix extrapolation in self-consistent geometry optimization
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2010-03-23
err6
errOAAI
errNiklasson, Anders M. N.; Challacombe, Matt; Tymczak, C. J.; Nemeth, Karoly
err分享
err收藏
The Choice of Internal Coordinates in Complex Chemical Systems
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2010-01-19
err9
PREAI
errNemeth, Karoly; Challacombe, Matt; Van Veenendaal, Michel
err分享
err收藏
Higher-order symplectic integration in Born-Oppenheimer molecular dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-12-28
err34
PREAI
errOdell, Anders; Delin, Anna; Johansson, Borje; Bock, Nicolas; Challacombe, Matt; Niklasson, Anders M. N.
err分享
err收藏
Extended Lagrangian Born-Oppenheimer molecular dynamics with dissipation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-06-04
err119
errOAAI
errNiklasson, Anders M. N.; Steneteg, Peter; Odell, Anders; Bock, Nicolas; Challacombe, Matt; Tymczak, C. J.; Holmstroem, Erik; Zheng, Guishan; Weber, Valery
err分享
err收藏
Representation independent algorithms for molecular response calculations in time-dependent self-consistent field theories在时间相关的自洽场理论中用于分子响应计算的表示独立算法
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-02-04
err91
errOAAI
errTretiak, Sergei; Isborn, Christine M.; Niklasson, Anders M. N.; Challacombe, Matt
err分享
err收藏
Molecular-orbital-free algorithm for excited states in time-dependent perturbation theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-08-14
err17
errOAAI
errLucero, Melissa J.; Niklasson, Anders M. N.; Tretiak, Sergei; Challacombe, Matt
err分享
err收藏
Equation of state and optical properties of warm dense helium
errPHYSICAL REVIEW B
IF3.7
err2007-08-10
err64
PREAI
errKowalski, P. M.; Mazevet, S.; Saumon, D.; Challacombe, M.
err分享
err收藏
Time-reversible ab initio molecular dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2007-04-10
err45
PREAI
errNiklasson, Anders M. N.; Tymczak, C. J.; Challacombe, Matt
err分享
err收藏
Parallel algorithm for the computation of the Hartree-Fock exchange matrix: Gas phase and periodic parallel ONX
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2006-09-13
err12
PREAI
errWeber, Valery; Challacombe, Matt
err分享
err收藏
Energy gradients with respect to atomic positions and cell parameters for the Kohn-Sham density-functional theory at the Γ point
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2006-06-13
err2
PREAI
errWeber, Valery; Tymczak, Christopher J.; Challacombe, Matt
err分享
err收藏
Exchange energy gradients with respect to atomic positions and cell parameters within the Hartree-Fock Γ-point approximation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2006-06-07
err3
PREAI
errWeber, Valery; Daul, Claudo; Challacombe, Matt
err分享
err收藏
Nonorthogonal density-matrix perturbation theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-08-03
err21
errOAAI
errNiklasson, AMN; Weber, V; Challacombe, M
err分享
err收藏
Higher-order response in O(N) by perturbed projection -: art. no. 044106
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-08-03
err23
errOAAI
errWeber, V; Niklasson, AMN; Challacombe, M
err分享
err收藏
Linear scaling computation of the Fock matrix.: VII.: Periodic density functional theory at the Γ point -: art. no. 134102
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-04-01
err12
errOAAI
errTymczak, CJ; Challacombe, M
err分享
err收藏
Linear scaling computation of the Fock matrix.: VIII.: Periodic boundaries for exact exchange at the Γ point -: art. no. 124105
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-03-28
err27
errOAAI
errTymczak, CJ; Weber, VT; Schwegler, E; Challacombe, M
err分享
err收藏
Linear scaling computation of the Fock matrix. VII. Parallel computation of the Coulomb matrix
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2004-10-08
err23
errOAAI
errGan, CK; Tymczak, CJ; Challacombe, M
err分享
err收藏
The quasi-independent curvilinear coordinate approximation for geometry optimization
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2004-07-30
err20
PREAI
errNémeth, K; Challacombe, M
err分享
err收藏
Linear scaling computation of the Fock matrix. VI. Data parallel computation of the exchange-correlation matrix
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2003-05-22
err24
PREAI
errGan, CK; Challacombe, M
err分享
err收藏

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