Winmostar™を使った定期講習会

Winmostar 2015 9 2 Winmostar etc2 Copyright (C) 2008-2015 X-Ability Co.,Ltd. All rights reserved. MOPAC6 MOPAC7 CNDO/SUV-VIS Gaussian GAMESS Gromacs LAMMPS Winmostar 3 GUI (MO) (MD) Copyright (C) 2008-2015 X-Ability Co.,Ltd. All rights V5 4 Gromacs, LAMMPS MD NWChem (C) 2008-2015 X-Ability Co.,Ltd. All rights (C) 2008-2015 X-Ability Co.,Ltd. All rights reserved. 11 Oct 2011 Winmostar AM1 EF PRECISE GNORM= NOINTER GRAPHFW inmostarO 0 0 0 0 0 0 0 0 0H 1 0 0 0 0 1 0 0H 1 1 0 0 1 2 0AM1 EF PRECISE GNORM= NOINTER GRAPHFW inmostarATOM CHEMICAL BOND LENGTH BOND ANGLE TWIST ANGLENUMBER SYMBOL (ANGSTROMS) (DEGREES) (DEGREES)(I)

Winmostar MOPAC 初期構造の作成 Gaussian GAMESS AM1 EF PRECISE GNORM=0.05 NOINTER GRAPHF Winmostar C 0.561887 1 0.141227 1 -0.051262 1

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