About: Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules

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About: Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules Goto Sponge NotDistinct Permalink

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rdf:type	Item
description	article (en) wetenschappelijk artikel (nl) наукова стаття, опублікована в липні 1992 (uk) article scientifique publié en 1992 (fr) im Juli 1992 veröffentlichter wissenschaftlicher Artikel (de)
publication date	wds:Q58446052-E74971DD-EA20-42A9-9364-94D7BB5B1471
publication date	1992-07-01 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q58446052-FE0D36A4-9D66-42B2-8B81-8206CEE03230
language of work or name	English
cites work	wds:Q58446052-0B52D7FD-8AEB-421A-A63D-266F61447E16 wds:Q58446052-2CABBEE7-91AC-453E-A317-02B3A8F0139A wds:Q58446052-2F89FE51-FFC0-4787-B3C1-D2EAB8F5C765 wds:Q58446052-F7D1E89F-E26E-4D22-B5D3-72C7401AAC7E
cites work	The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors Ab initio calculations on the structure, stabilization, and dipole moment of benzene⋅⋅⋅Ar complex Intermolecular interactions between medium-sized systems. Nonempirical and empirical calculations of interaction energies. Successes and failures Floppy structure of the benzene dimer: Ab initio calculation on the structure and dipole moment
author name string	wds:Q58446052-7B20FE56-3EEE-4B46-BCE1-A8D8481784F2 wds:Q58446052-9927C058-0A8A-46F0-AAE2-BC2C8676578D wds:Q58446052-B0CBDBB0-0C05-4260-9193-57ACAA0C1C7B
author name string	E. W. Schlag H. L. Selzle Ota Bludský
rdfs:label	Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (en) Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (nl)
skos:prefLabel	Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (en) Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (nl)
name	Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (en) Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (nl)
author	wds:Q58446052-EA2F56B0-9773-4EFD-A857-25800E2518D0
author	Pavel Hobza
title	wds:Q58446052-19F49714-86E7-4C64-905B-53F964F5A4C7
title	Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe) van der Waals molecules (en)
page(s)	wds:Q58446052-CB5DA393-9EFF-444B-B2D4-73E7CC05C752
page(s)	335-340
instance of	wds:Q58446052-4E23DB25-48A3-4256-8D82-C67F7A856E76
instance of	scholarly article
main subject	wds:Q58446052-91A9A9E2-AAFC-4E4A-A16B-D47D43113A79
main subject	wd:Q2270
published in	wds:Q58446052-29363C3A-85BD-422A-88F4-4C7DBA4159E3
published in	Journal of Chemical Physics
issue	wds:Q58446052-AF39249C-A44D-4687-9702-2F3E47FE52D7
volume	wds:Q58446052-F22E260F-6339-43CC-80BC-E9136DF8B128
issue	1
volume	97
DOI	wds:Q58446052-B530E528-5E6C-454B-B568-EAAAE1BB3BAD
DOI	http://dx.doi.org/10.1063/1.463578
DOI	10.1063/1.463578
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q58446052
is cites work of	Structure and energetics of the anisole-Ar(n) (n = 1, 2, 3) complexes: high-resolution resonant two-photon and threshold ionization experiments, and quantum chemical calculations Interaction energies and NMR chemical shifts of noble gases in C60 Theoretical studies of potential energy surface and rotational spectra of Xe-H(2)O van der Waals complex Well-balanced basis sets for second-order Møller-Plesset treatment of argon-aromatic molecule complexes. Fully dimensional ab initio description of the structure and energetics of azabenzene-argon complexes. Structure and stability of fluorine-substituted benzene-argon complexes: The decisive role of exchange-repulsion and dispersion interactions On the thermodynamic characteristics of the benzene ? Ar2 complex: An application of the ab initio intermolecular potential Penning ionization electron spectroscopy of C6H6 by collision with He*(2 3 S) metastable atoms and classical trajectory calculations: optimization of ab initio model potentials Computational and experimental investigation of intermolecular states and forces in the benzene–helium van der Waals complex The benzene–argon complex: A ground and excited state ab initio study Characteristics and relaxation dynamics of van der Waals complexes between p-difluorobenzene and Ne. Ground state potential surface for van der Waals complexes: Ab initio second‐order Mo/ller–Plesset study on benzene...N2 van der Waals molecule Effects of an electric field on interaction of aromatic systems Properties of fluorobenzene⋅⋅⋅Ar and p‐difluorobenzene⋅⋅⋅Ar complexes: Ab initio study Interaction of phenol with xenon and nitrogen: spectroscopic and computational characterization. The study of basis sets for the calculation of the structure and dynamics of the benzene-Kr complex.
is cites work of	wds:Q35610975-41619099-1E49-4D73-96C2-83F999E9D5A9 wds:Q45289523-B6FE2976-44A2-4435-A57D-3847706B1DD9 wds:Q59464559-0B4AE0CC-701C-4520-A424-1CE25D7DA605 wds:Q58445925-E9A6991C-7D9D-4D04-888A-BA4A9B32B798 wds:Q57941789-C9E0FD55-B7CE-4DF7-851C-691D90320361 wds:Q33388391-FE78E8A9-30F1-4054-8D20-F7EB98CBA3DE wds:Q46777115-4F8E4FFA-1707-4A11-96EF-474B52C16B1D wds:Q51635193-E825764F-5507-4866-8E94-4D72B29D6608 wds:Q57398150-314E1AE9-8D58-4E2A-AE61-9138041CA4F9 wds:Q53671284-60364086-89AC-47D1-A97C-11B46917593C wds:Q58446025-269166D0-0E74-4C02-BFD8-157D64D64E6C wds:Q57943869-507CAA50-3F23-40E3-886A-0D5E602019C0 wds:Q44988942-67AC48DB-CD93-44F4-8462-585B41F17E5E wds:Q48125827-8CBF5C27-8E78-43A3-8698-D6638FFF3A5C wds:Q58446037-EF77C307-C5C6-4E9E-ABB9-8E5445FAD213 wds:Q62579101-B7D3325E-0E62-42F8-A186-EA4C57E59F33

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