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Stephen T Elbert
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General atomic and molecular electronic structure system
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
Journal of computational chemistry 14 (11), 1347-1363, 1993
225761993
Gamess
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
Quantum Chem. Prog. Exchange Bull 10, 52-54, 1990
6891990
Are atoms intrinsic to molecular electronic wavefunctions? I. The FORS model
K Ruedenberg, MW Schmidt, MM Gilbert, ST Elbert
Chemical Physics 71 (1), 41-49, 1982
640*1982
Entropia: architecture and performance of an enterprise desktop grid system
A Chien, B Calder, S Elbert, K Bhatia
Journal of Parallel and Distributed Computing 63 (5), 597-610, 2003
5012003
MCSCF optimization through combined use of natural orbitals and the brillouin–levy–berthier theorem
K Ruedenberg, LM Cheung, ST Elbert
International Journal of Quantum Chemistry 16 (5), 1069-1101, 1979
3301979
Jr, JAMJ Comput
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
Chem 14, 1347, 1993
189*1993
The changing paradigm of data-intensive computing
RT Kouzes, GA Anderson, ST Elbert, I Gorton, DK Gracio
Computer 42 (1), 26-34, 2009
1752009
Potential energy surfaces of ozone. I
SS Xantheas, GJ Atchity, ST Elbert, K Ruedenberg
The Journal of chemical physics 94 (12), 8054-8069, 1991
1501991
A configuration interaction study of the spin dipole‐dipole parameters for formaldehyde and methylene
SR Langhoff, ST Elbert, ER Davidson
International Journal of Quantum Chemistry 7 (5), 999-1019, 1973
1201973
An intersection seam between the ground state of ozone and an excited state of like symmetrya)
S Xantheas, ST Elbert, K Ruedenberg
The Journal of chemical physics 93 (10), 7519-7521, 1990
861990
The design of a scalable, fixed-time computer benchmark
J Gustafson, D Rover, S Elbert, M Carter
Journal of Parallel and Distributed Computing 12 (4), 388-401, 1991
671991
General atomic and molecular electronic structure system
MW Smidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
J. Comput. Chem 14, 1347, 1993
661993
T. L, Windus, M. Dupuis, and JA Montgomery, Jr
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
J. Comp. Chem 14, 1347, 1993
651993
Montgo-mery JA
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
J. Comput. Chem. 14, 1347, 1993
641993
New version of GAMESS
STE MW Schimdt, KK Baldridge, JA Boatz, JH Jesen, S Koseki, MS Gordon, KA ...
QCPE Bull 10, 52, 1990
64*1990
The ring opening of cyclopropylidene to allene: global features of the reaction surface
P Valtazanos, ST Elbert, S Xantheas, K Ruedenberg
Theoretica chimica acta 78 (5), 287-326, 1991
611991
Gamess, version 11
MW Schmidt, KK Baldridge, JA Boatz, ST Elbert, MS Gordon, JH Jensen, ...
Iowa State University: Ames, IA, 2008
552008
The ring opening of cyclopropylidene to allene: key features of the accurate reaction surface
S Xantheas, ST Elbert, K Ruedenberg
Theoretica chimica acta 78 (5), 365-395, 1991
531991
Ab initio calculations on urea
ST Elbert, ER Davidson
International Journal of Quantum Chemistry 8 (6), 857-892, 1974
491974
Ring opening of cyclopropylidenes to allenes: reactions with bifurcating transition regions, free internal motions, steric hindrances, and long-range dipolar interactions
P Valtazanos, ST Elbert, K Ruedenberg
Journal of the American Chemical Society 108 (11), 3147-3149, 1986
481986
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