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Botella, V., Castaño, O., Fernández-Serra, P., Smeyers, Y.G. (1994) Multiple solutions and spatial symmetry properties of singlet and triplet states in the half-projected Hartree-Fock method. Chemical Physics Letters, 219. 497-501 doi:10.1016/0009-2614(94)00112-x

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Reference TypeJournal (article/letter/editorial)
TitleMultiple solutions and spatial symmetry properties of singlet and triplet states in the half-projected Hartree-Fock method
JournalChemical Physics Letters
AuthorsBotella, V.Author
Castaño, O.Author
Fernández-Serra, P.Author
Smeyers, Y.G.Author
Year1994 (March)Volume219
PublisherElsevier BV
DOIdoi:10.1016/0009-2614(94)00112-xSearch in ResearchGate
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Mindat Ref. ID5890757Long-form Identifiermindat:1:5:5890757:7
GUID0
Full ReferenceBotella, V., Castaño, O., Fernández-Serra, P., Smeyers, Y.G. (1994) Multiple solutions and spatial symmetry properties of singlet and triplet states in the half-projected Hartree-Fock method. Chemical Physics Letters, 219. 497-501 doi:10.1016/0009-2614(94)00112-x
Plain TextBotella, V., Castaño, O., Fernández-Serra, P., Smeyers, Y.G. (1994) Multiple solutions and spatial symmetry properties of singlet and triplet states in the half-projected Hartree-Fock method. Chemical Physics Letters, 219. 497-501 doi:10.1016/0009-2614(94)00112-x
In(n.d.) Chemical Physics Letters Vol. 219. Elsevier BV

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Castaño, O., Smeyers, Y.G., Ruiz, M.-B., Hernández-Laguna, A., Botella-Olcina, V., Fernández-Serra, P. (1993) The half-projected Hartree-Fock method: some new aspects. Journal of Molecular Structure: THEOCHEM, 287. 55-61 doi:10.1016/0166-1280(93)87203-p
Smeyers, Yves G., Ruiz, M.Belén, Otto, Peter P. (1997) The half projected Hartree-Fock function for determining singlet excited states. Application to cyclobutanone and 3-cyclopenten-1-one. Journal of Molecular Structure: THEOCHEM, 390. 91-99 doi:10.1016/s0166-1280(96)04763-x
Jaworska, Maria, Lodowski, Piotr, Nowakowski, Janusz (1995) Broken-symmetry Hartree-Fock solutions in the RHF wavefunction of dicyclobutadienenickel. Chemical Physics Letters, 232. 328-334 doi:10.1016/0009-2614(94)01373-4
Astilean, S., Chitta, V., Corval, A., Miller, R.J.D., Trommsdorff, H.P. (1994) Singlet—triplet level crossings in matrix-isolated pentacene. Chemical Physics Letters, 219. 95-100 doi:10.1016/0009-2614(94)00064-6
Lunell, S. (1972) On the use of general spin orbitals in the projected Hartree-Fock method. Chemical Physics Letters, 13. 93-96 doi:10.1016/0009-2614(72)80052-6
Baerends, E.J., Ros, P. (1973) Level ordering in ferrocence. A comparision between the hartree-fock-slater and hartree-fock models. Chemical Physics Letters, 23. 391-393 doi:10.1016/0009-2614(73)85105-x
Barone, Vincenzo (1994) Inclusion of Hartree-Fock exchange in the density functional approach. Benchmark computations for diatomic molecules containing H, B, C, N, O, and F atoms. Chemical Physics Letters, 226. 392-398 doi:10.1016/0009-2614(94)00725-x
Ruiz, M.Belén, Otto, Peter, Smeyers, Yves G. (1996) The simplex method for geometry optimization in half-projected Hartree-Fock calculations of excited states. Journal of Molecular Structure: THEOCHEM, 365. 151-165 doi:10.1016/0166-1280(96)04478-8
Darmanyan, A.P. (1984) Experimental study of singlet-triplet energy transfer in liquid solutions. Chemical Physics Letters, 110. 89-94 doi:10.1016/0009-2614(84)80152-9
Plakhutin, B.N. (1994) Hartree—Fock states energy spectra for icosahedral open-shell structures with electronic configurations gN (N=1–7). Chemical Physics Letters, 227. 396-400 doi:10.1016/0009-2614(94)00827-2
Tatewaki, Hiroshi, Koga, Toshikatsu (1994) Numerical Hartree-Fock energies of low-lying excited states of neutral atoms with 19⩽Z⩽36. Chemical Physics Letters, 228. 562-567 doi:10.1016/0009-2614(94)00993-7
 
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