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- W2768072658 endingPage "1189" @default.
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- W2768072658 abstract "This chapter focuses on the new developments in electronic structure theory during the past decade. These developments include new methods in quantum mechanics, including approaches for extrapolating to the full CI and complete basis set limits, novel methods for CASSCF calculations, new coupled cluster techniques, methods for evaluating non-adiabatic and relativistic interactions, new approaches for distributed parallel computing, and QM/MM methods for describing solvent effects and surface science. It is useful to note in this regard that GAMESS is a general-purpose suite of electronic structure and QM/MM methods (including open-and closed-shell Hartree–Fock which has been essentially ignored here) that can be run on virtually any computer, cluster, massively parallel system, or for that matter a desktop Mac or PC. Indeed, GAMESS is used at many universities as an educational tool, making use of its graphical back end MacMolPlt. GAMESS and MacMolPlt can be downloaded at no cost from www.msg.ameslab.gov, with only a simple license required." @default.
- W2768072658 created "2017-11-17" @default.
- W2768072658 creator A5010977651 @default.
- W2768072658 creator A5060703811 @default.
- W2768072658 date "2005-01-01" @default.
- W2768072658 modified "2023-10-10" @default.
- W2768072658 title "Advances in electronic structure theory" @default.
- W2768072658 cites W1486816649 @default.
- W2768072658 cites W1546349889 @default.
- W2768072658 cites W1585091301 @default.
- W2768072658 cites W1634997895 @default.
- W2768072658 cites W1963737263 @default.
- W2768072658 cites W1965087316 @default.
- W2768072658 cites W1966395558 @default.
- W2768072658 cites W1969996296 @default.
- W2768072658 cites W1971366372 @default.
- W2768072658 cites W1972806457 @default.
- W2768072658 cites W1975845692 @default.
- W2768072658 cites W1976059606 @default.
- W2768072658 cites W1976251388 @default.
- W2768072658 cites W1977691562 @default.
- W2768072658 cites W1978108417 @default.
- W2768072658 cites W1979111298 @default.
- W2768072658 cites W1979459237 @default.
- W2768072658 cites W1981054690 @default.
- W2768072658 cites W1981717507 @default.
- W2768072658 cites W1984139317 @default.
- W2768072658 cites W1985175271 @default.
- W2768072658 cites W1985759756 @default.
- W2768072658 cites W1986130927 @default.
- W2768072658 cites W1986439999 @default.
- W2768072658 cites W1986506484 @default.
- W2768072658 cites W1988301945 @default.
- W2768072658 cites W1989704985 @default.
- W2768072658 cites W1990653933 @default.
- W2768072658 cites W1997665321 @default.
- W2768072658 cites W1997880659 @default.
- W2768072658 cites W1998762629 @default.
- W2768072658 cites W1999514046 @default.
- W2768072658 cites W2000181734 @default.
- W2768072658 cites W2002048114 @default.
- W2768072658 cites W2002150668 @default.
- W2768072658 cites W2003320348 @default.
- W2768072658 cites W2004422340 @default.
- W2768072658 cites W2010084331 @default.
- W2768072658 cites W2010170813 @default.
- W2768072658 cites W2013266749 @default.
- W2768072658 cites W2014259011 @default.
- W2768072658 cites W2014894160 @default.
- W2768072658 cites W2015325351 @default.
- W2768072658 cites W2015926027 @default.
- W2768072658 cites W2016473610 @default.
- W2768072658 cites W2016773722 @default.
- W2768072658 cites W2016851069 @default.
- W2768072658 cites W2017164460 @default.
- W2768072658 cites W2017192110 @default.
- W2768072658 cites W2020187319 @default.
- W2768072658 cites W2020692466 @default.
- W2768072658 cites W2022950330 @default.
- W2768072658 cites W2023677120 @default.
- W2768072658 cites W2023688555 @default.
- W2768072658 cites W2025658864 @default.
- W2768072658 cites W2027814028 @default.
- W2768072658 cites W2029453528 @default.
- W2768072658 cites W2030422329 @default.
- W2768072658 cites W2032334443 @default.
- W2768072658 cites W2032436962 @default.
- W2768072658 cites W2038083805 @default.
- W2768072658 cites W2039559098 @default.
- W2768072658 cites W2040626072 @default.
- W2768072658 cites W2042453106 @default.
- W2768072658 cites W2042861886 @default.
- W2768072658 cites W2043485146 @default.
- W2768072658 cites W2045146272 @default.
- W2768072658 cites W2046465449 @default.
- W2768072658 cites W2052312990 @default.
- W2768072658 cites W2052332029 @default.
- W2768072658 cites W2053744228 @default.
- W2768072658 cites W2054313762 @default.
- W2768072658 cites W2054895880 @default.
- W2768072658 cites W2055205030 @default.
- W2768072658 cites W2056242144 @default.
- W2768072658 cites W2057400544 @default.
- W2768072658 cites W2058142046 @default.
- W2768072658 cites W2058848030 @default.
- W2768072658 cites W2060442744 @default.
- W2768072658 cites W2060608642 @default.
- W2768072658 cites W2061801149 @default.
- W2768072658 cites W2063592080 @default.
- W2768072658 cites W2063622499 @default.
- W2768072658 cites W2065878523 @default.
- W2768072658 cites W2067724923 @default.
- W2768072658 cites W2069655701 @default.
- W2768072658 cites W2070000916 @default.
- W2768072658 cites W2072337278 @default.
- W2768072658 cites W2073158900 @default.
- W2768072658 cites W2074204869 @default.
- W2768072658 cites W2074824070 @default.