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Results: 1-6 |
Results: 6

Authors: Lewis, JP Glaesemann, KR Voth, GA Fritsch, J Demkov, AA Ortega, J Sankey, OF
Citation: Jp. Lewis et al., Further developments in the local-orbital density-functional-theory tight-binding method - art. no. 195103, PHYS REV B, 6419(19), 2001, pp. 5103

Authors: Lewis, JP Glaesemann, KR VanOpdorp, K Voth, GA
Citation: Jp. Lewis et al., Ab initio calculations of reactive pathways for alpha-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (alpha-HMX), J PHYS CH A, 104(48), 2000, pp. 11384-11389

Authors: Glaesemann, KR Gordon, MS
Citation: Kr. Glaesemann et Ms. Gordon, Auxiliary basis sets for grid-free density functional theory, J CHEM PHYS, 112(24), 2000, pp. 10738-10745

Authors: Glaesemann, KR Gordon, MS Nakano, H
Citation: Kr. Glaesemann et al., A study of FeCO+ with correlated wavefunctions, PCCP PHYS C, 1(6), 1999, pp. 967-975

Authors: Gordon, MS Schmidt, MW Chaban, GM Glaesemann, KR Stevens, WJ Gonzalez, C
Citation: Ms. Gordon et al., A natural orbital diagnostic for multiconfigurational character in correlated wave functions, J CHEM PHYS, 110(9), 1999, pp. 4199-4207

Authors: Glaesemann, KR Gordon, MS
Citation: Kr. Glaesemann et Ms. Gordon, Evaluation of gradient corrections in grid-free density functional theory, J CHEM PHYS, 110(13), 1999, pp. 6580-6582
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