![Theoretical chemistry / Computational physics / Molecular modelling / Gaussian / Hartree–Fock method / ONIOM / Density functional theory / Molecular mechanics / Time-dependent density functional theory / Chemistry / Computational chemistry / Quantum chemistry Theoretical chemistry / Computational physics / Molecular modelling / Gaussian / Hartree–Fock method / ONIOM / Density functional theory / Molecular mechanics / Time-dependent density functional theory / Chemistry / Computational chemistry / Quantum chemistry](https://www.pdfsearch.io/img/f65bbbe3739b4545d38a52862dec754e.jpg)
| Document Date: 2014-02-27 14:34:47 Open Document File Size: 184,50 KBShare Result on Facebook
Company CBS / Hess / Intel / / Facility Building Gaussian / ATLAS BLAS library / / IndustryTerm periodic systems / large systems / transition metal bonding / semi-direct algorithms / slow file systems / integral-direct algorithm / default algorithm / coordinate systems / kinetic-energy density / potential-energy surfaces / default optimization algorithm / default algorithms / semi-direct algorithm / chemical reaction dynamics / chemical-reactions / energy / / OperatingSystem Solaris / Microsoft Windows / / Person Todd Keith / / Position Herzberg-Teller / MP / polarizable continuum model / ” J. Phys / General / Franck-Condon-Herzberg-Teller / / ProvinceOrState Rydberg / / Technology default algorithms / default algorithm / optimization algorithms / dielectric / Spectroscopy / integral-direct algorithm / simulation / default optimization algorithm / default IRC algorithm / semi-direct algorithm / semi-direct algorithms / /
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