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Results: 1-5 |
Results: 5

Authors: Stephens, PJ Devlin, FJ Cheeseman, JR Frisch, MJ
Citation: Pj. Stephens et al., Calculation of optical rotation using density functional theory, J PHYS CH A, 105(22), 2001, pp. 5356-5371

Authors: Cheeseman, JR Frisch, MJ Devlin, FJ Stephens, PJ
Citation: Jr. Cheeseman et al., Hartree-Fock and density functional theory ab initio calculation of optical rotation using GIAOs: Basis set dependence, J PHYS CH A, 104(5), 2000, pp. 1039-1046

Authors: Stephens, PJ Devlin, FJ Cheeseman, JR Frisch, MJ Mennucci, B Tomasi, J
Citation: Pj. Stephens et al., Prediction of optical rotation using density functional theory: 6,8-dioxabicyclo[3.2.1]octanes, TETRAHEDR-A, 11(12), 2000, pp. 2443-2448

Authors: Wiberg, KB Hammer, JD Zilm, KW Cheeseman, JR
Citation: Kb. Wiberg et al., NMR chemical shifts. 3. A comparison of acetylene, allene, and the higher cumulenes, J ORG CHEM, 64(17), 1999, pp. 6394-6400

Authors: Biedermann, PU Cheeseman, JR Frisch, MJ Schurig, V Gutman, I Agranat, I
Citation: Pu. Biedermann et al., Conformational spaces and absolute configurations of chiral fluorinated inhalation anaesthetics. A theoretical study, J ORG CHEM, 64(11), 1999, pp. 3878-3884
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