About: Ab initio prediction of fundamental, overtone and combination band infrared intensities

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rdf:type	Item
description	article (en) հոդված (hy) wetenschappelijk artikel (nl) наукова стаття, опублікована в травні 1990 (uk) article scientifique publié en 1990 (fr) im Mai 1990 veröffentlichter wissenschaftlicher Artikel (de)
publication date	wds:Q62732718-A42D2E09-7DD9-4989-B9BF-3C262CA9DA39
publication date	1990-05-01 00:00:00Z (xsd:dateTime)
author name string	wds:Q62732718-6989E6C1-A78B-4A25-A50F-4C11DD66F833 wds:Q62732718-6DAAECF7-2F71-4C45-8D3D-D6FD91CFEB57 wds:Q62732718-B06B8579-02FA-4101-896D-DAFC9C7AF5E2 wds:Q62732718-E83D6717-A06D-4FAE-95E0-03A03634619E
author name string	Dylan Jayatilaka Nicholas C. Handy William H. Green Andrew Willetts
rdfs:label	Ab initio prediction of fundamental, overtone and combination band infrared intensities (en) Ab initio prediction of fundamental, overtone and combination band infrared intensities (nl)
skos:prefLabel	Ab initio prediction of fundamental, overtone and combination band infrared intensities (en) Ab initio prediction of fundamental, overtone and combination band infrared intensities (nl)
name	Ab initio prediction of fundamental, overtone and combination band infrared intensities (en) Ab initio prediction of fundamental, overtone and combination band infrared intensities (nl)
title	wds:Q62732718-F3F03D98-BB7A-435C-8E3D-D1656A7E6526
title	Ab initio prediction of fundamental, overtone and combination band infrared intensities (en)
page(s)	wds:Q62732718-2B490116-87F5-490F-9ED8-031316B5DA66
page(s)	127-137
instance of	wds:Q62732718-F91F7A82-4750-435C-9DF1-52B54F9CA0B2
instance of	scholarly article
published in	wds:Q62732718-135A8ABB-2FF2-4156-A011-6EAE564A13F0
published in	Chemical Physics Letters
issue	wds:Q62732718-2229608F-8228-4C09-A175-7711C3E45428
volume	wds:Q62732718-2DBD64F3-6FA8-49B0-9B75-6DEF4DE66B8C
issue	1-2
volume	169
DOI	wds:Q62732718-85990095-D9CF-43A7-AC13-C85192B47FE6
DOI	http://dx.doi.org/10.1016/0009-2614(90)85177-E
DOI	10.1016/0009-2614(90)85177-E
is owl:sameAs of	Ab initio prediction of fundamental, overtone and combination band infrared intensities
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q62732718
is cites work of	Molecular modeling of solvation. Cl−(D2O) Calculation of vibrational (J=0) excitation energies and band intensities of formaldehyde using the recursive residue generation method The prediction of spectroscopic properties from quartic correlated force fields: HCCF, HFCO, SiH+3
is cites work of	wds:Q59782023-01DBAF39-2988-4209-9C7F-C198FD8F9BAA wds:Q57402503-5F4ACE60-BD27-419B-BAE9-CE028BD7B439 wds:Q62732731-FFAC0A4D-6D4C-40D9-B8A9-A5DE3D01FDD1

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