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Olsen, Jeppe, Jo/rgensen, Poul (1982) Update methods in multiconfigurational self‐consistent field calculations. The Journal of Chemical Physics, 77 (12) 6109-6130 doi:10.1063/1.443856

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Reference TypeJournal (article/letter/editorial)
TitleUpdate methods in multiconfigurational self‐consistent field calculations
JournalThe Journal of Chemical Physics
AuthorsOlsen, JeppeAuthor
Jo/rgensen, PoulAuthor
Year1982 (December 15)Volume77
Issue12
PublisherAIP Publishing
DOIdoi:10.1063/1.443856Search in ResearchGate
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Mindat Ref. ID2139146Long-form Identifiermindat:1:5:2139146:0
GUID0
Full ReferenceOlsen, Jeppe, Jo/rgensen, Poul (1982) Update methods in multiconfigurational self‐consistent field calculations. The Journal of Chemical Physics, 77 (12) 6109-6130 doi:10.1063/1.443856
Plain TextOlsen, Jeppe, Jo/rgensen, Poul (1982) Update methods in multiconfigurational self‐consistent field calculations. The Journal of Chemical Physics, 77 (12) 6109-6130 doi:10.1063/1.443856
In(1982, December) The Journal of Chemical Physics Vol. 77 (12) AIP Publishing

See Also

These are possibly similar items as determined by title/reference text matching only.

Olsen, Jeppe, Jo/rgensen, Poul, Yeager, Danny L. (1982) Cubic contributions in multiconfigurational self‐consistent‐field (MCSCF) calculations. The Journal of Chemical Physics, 77 (1) 356-370 doi:10.1063/1.443614
Hettema, Hinne, Jensen, Hans Jo/rgen Aa., Jo/rgensen, Poul, Olsen, Jeppe (1992) Quadratic response functions for a multiconfigurational self‐consistent field wave function. The Journal of Chemical Physics, 97 (2). 1174-1190 doi:10.1063/1.463245
Bak, Keld Lars, Jo/rgensen, Poul, Jensen, Hans Jo/rgen Aa., Olsen, Jeppe, Helgaker, Trygve (1992) First‐order nonadiabatic coupling matrix elements from multiconfigurational self‐consistent‐field response theory. The Journal of Chemical Physics, 97 (10). 7573-7584 doi:10.1063/1.463477
Jo/rgensen, Poul, Jensen, Hans Jo/rgen Aagaard, Olsen, Jeppe (1988) Linear response calculations for large scale multiconfiguration self‐consistent field wave functions. The Journal of Chemical Physics, 89 (6). 3654-3661 doi:10.1063/1.454885
Jo/rgensen, Poul, Swanstro/m, Peter, Yeager, Danny L. (1983) Guaranteed convergence in ground state multiconfigurational self‐consistent field calculations. The Journal of Chemical Physics, 78 (1) 347-356 doi:10.1063/1.444508
Fernandez, Berta, Jo/rgensen, Poul, Byberg, Jo/rgen, Olsen, Jeppe, Helgaker, Trygve, Jensen, Hans Jo/rgen Aa. (1992) Spin polarization in restricted electronic structure theory: Multiconfiguration self‐consistent‐field calculations of hyperfine coupling constants. The Journal of Chemical Physics, 97 (5). 3412-3419 doi:10.1063/1.462977
Jensen, Hans Jo/rgen Aa., Jo/rgensen, Poul, Ågren, Hans, Olsen, Jeppe (1988) Second‐order Mo/ller–Plesset perturbation theory as a configuration and orbital generator in multiconfiguration self‐consistent field calculations. The Journal of Chemical Physics, 88 (6). 3834-3839 doi:10.1063/1.453884
Olsen, Jeppe, Jo/rgensen, Poul, Yeager, Danny L. (1982) Multiconfigurational Hartree–Fock studies of avoided curve crossing using the Newton–Raphson technique. The Journal of Chemical Physics, 76 (1) 527-542 doi:10.1063/1.442699
Yeager, Danny L., Lynch, Diane, Nichols, Jeffrey, Joergensen, Poul, Olsen, Jeppe (1982) Newton-Raphson approaches and generalizations in multiconfigurational self-consistent field calculations. The Journal of Physical Chemistry, 86 (12). 2140-2153 doi:10.1021/j100209a006
Jo/rgensen, Poul, Olsen, Jeppe, Yeager, Danny L. (1981) Generalizations of Newton–Raphson and multiplicity independent Newton–Raphson approaches in multiconfigurational Hartree–Fock theory. The Journal of Chemical Physics, 75 (12) 5802-5815 doi:10.1063/1.442029
Jensen, Hans Jo/rgen Aa., Jo/rgensen, Poul, Ågren, Hans, Olsen, Jeppe (1988) Erratum: Second‐order Mo/ller–Plesset perturbation theory as a configuration and orbital generator in multiconfiguration self‐consistent‐field calculations [J. Chem. Phys. 88, 3834 (1988)]. The Journal of Chemical Physics, 89 (8). 5354 doi:10.1063/1.455749
 
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