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Valiron, Pierre, Vibók, Ágnes, Mayer, István (1993) Comparison ofa posteriorianda prioriBSSE correction schemes for SCF intermolecular energies. Journal of Computational Chemistry, 14 (4). 401-409 doi:10.1002/jcc.540140404

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Reference TypeJournal (article/letter/editorial)
TitleComparison ofa posteriorianda prioriBSSE correction schemes for SCF intermolecular energies
JournalJournal of Computational Chemistry
AuthorsValiron, PierreAuthor
Vibók, ÁgnesAuthor
Mayer, IstvánAuthor
Year1993 (April)Volume14
Issue4
PublisherWiley
DOIdoi:10.1002/jcc.540140404Search in ResearchGate
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Mindat Ref. ID3146070Long-form Identifiermindat:1:5:3146070:5
GUID0
Full ReferenceValiron, Pierre, Vibók, Ágnes, Mayer, István (1993) Comparison ofa posteriorianda prioriBSSE correction schemes for SCF intermolecular energies. Journal of Computational Chemistry, 14 (4). 401-409 doi:10.1002/jcc.540140404
Plain TextValiron, Pierre, Vibók, Ágnes, Mayer, István (1993) Comparison ofa posteriorianda prioriBSSE correction schemes for SCF intermolecular energies. Journal of Computational Chemistry, 14 (4). 401-409 doi:10.1002/jcc.540140404
In(1993, April) Journal of Computational Chemistry Vol. 14 (4) Wiley

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Salvador, Pedro, Paizs, B�la, Duran, Miquel, Suhai, S�ndor (2001) On the effect of the BSSE on intermolecular potential energy surfaces. Comparison ofa priori anda posteriori BSSE correction schemes. Journal of Computational Chemistry, 22 (7). 765-786 doi:10.1002/jcc.1042
Halász, G., Vibók, Á., Valiron, P., Mayer, I. (1996) BSSE-Free SCF Algorithm for Treating Several Weakly Interacting Systems. The Journal of Physical Chemistry, 100 (15). 6332-6335 doi:10.1021/jp953084k
Mayer, I., Vibók, Á. (1987) Intermolecular SCF method without bsse: the closed-shell case. Chemical Physics Letters, 140. 558-564 doi:10.1016/0009-2614(87)80486-4
(1993) Masthead. Journal of Computational Chemistry, 14 (4). doi:10.1002/jcc.540140401
Masamura, Masao (2004) The effect of basis set superposition error on the convergence of intermolecular interaction energies for deprotonated complexes. Journal of Computational Chemistry, 25 (14). 1771-1778 doi:10.1002/jcc.20106
Vibók, Á., Mayer, I. (1988) Intermolecular SCF theory without BSSE: The equations and some applications for small systems. Journal of Molecular Structure: THEOCHEM, 170. 9-17 doi:10.1016/0166-1280(88)80043-5
Klobukowski, Mariusz (1993) Ab initio SCF and M�ller?plesset studies on hexafluorides of selenium and tellurium. Journal of Computational Chemistry, 14 (10). 1234-1239 doi:10.1002/jcc.540141012
Orozco, Modesto, Jorgensen, William L., Luque, F.J. (1993) Comparison of 6-31G*-based MST/SCRF and FEP evaluations of the free energies of hydration for small neutral molecules. Journal of Computational Chemistry, 14 (12). 1498-1503 doi:10.1002/jcc.540141212
Baker, Jon (1993) Techniques for geometry optimization: A comparison of cartesian and natural internal coordinates. Journal of Computational Chemistry, 14 (9). 1085-1100 doi:10.1002/jcc.540140910
Masoumifeshani, Emran, Korona, Tatiana (2024) Intermolecular interaction energies with AROFRAG–A systematic approach for fragmentation of aromatic molecules. Journal of Computational Chemistry, 45 (29). doi:10.1002/jcc.27429
(1993) Masthead. Journal of Computational Chemistry, 14 (1). doi:10.1002/jcc.540140101
 
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