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Semiempirical calcu...
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Stashans, AUppsala universitet,Institutionen för kvantkemi
(author)
Semiempirical calculations on WO3 and MxWO3 crystals (M=H, Li, Na)
- Article/chapterEnglish1997
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Numbers
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LIBRIS-ID:oai:DiVA.org:uu-41628
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https://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-41628URI
Supplementary language notes
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Language:English
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Summary in:English
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Classification
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Subject category:vet swepub-contenttype
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Subject category:art swepub-publicationtype
Notes
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Stashans A, UNIV UPPSALA, DEPT QUANTUM CHEM, BOX 518, S-75120 UPPSALA, SWEDEN.
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The monoclinic structure of tungsten trioxide WO3 has been studied by combining a modified intermediate neglect of differential overlap (INDO) method and the supercell model. The fitted semiempirical parameters describe very well the features of the band
Subject headings and genre
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intercalation; WO3; impurities; optical properties; tungsten oxide; CORUNDUM CRYSTALS; THIN-FILMS; CENTERS; STATES; OXIDE; PHOTOELECTROLYSIS; PARAMETRIZATION; INSERTION; CLUSTERS; MODELS
Added entries (persons, corporate bodies, meetings, titles ...)
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Lunell, S
(author)
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Uppsala universitetInstitutionen för kvantkemi
(creator_code:org_t)
Related titles
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In:INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY63:3, s. 729-7350020-7608
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