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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 35, 1978 - Issue 1
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Original Articles

Comparison of SCF-Xα-SW and CNDO/BW calculations on S4N4H4 and F4S4N4

Aniko E. Foti Chemistry Department, Queen's University, Kingston, Ontario, K7L 3N6
,
Vedene H. Smith Jr. Chemistry Department, Queen's University, Kingston, Ontario, K7L 3N6
,
S. Kishner Chemistry Department, McGill University, Montreal, Quebec, H3A 2K6
,
M.S. Gopinathan Chemistry Department, McGill University, Montreal, Quebec, H3A 2K6; Department of Chemistry, Indian Institute of Technology, Madras, 60036, India
&
M.A. Whitehead Chemistry Department, McGill University, Montreal, Quebec, H3A 2K6
Pages 111-127 | Received 05 Apr 1977, Published online: 22 Aug 2006

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AnikoE. Foti, VedeneH. Smith$suffix/text()$suffix/text() & M.A. Whitehead. (1982) Bonding in titanium chloride TiCl4 . Molecular Physics 45:2, pages 385-396.
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Articles from other publishers (13)

James O. Jensen. (2004) Vibrational frequencies and structural determination of 1,3,5,7,2,4,6,8-tetrathiatetrazocine. Journal of Molecular Structure: THEOCHEM 685:1-3, pages 191-206.
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Michael H. Palmer, Richard T. Oakley & Nicholas P.C. Westwood. (1989) Photoelectron and ab initio configuration interaction studies of (NSF)3 and (NSF)4; Trends, and geometric and electronic structures in the (NSF)x(x = 1, 2, 3, and 4) series. Chemical Physics 131:2-3, pages 255-265.
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. (1985) Referate. Zeitschrift für Kristallographie 170:1-4, pages 1-201.
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T. J. Tseng & M. A. Whitehead. (2004) Localized molecular orbital energies within the CNDO / BW formulation . Journal of Computational Chemistry 3:4, pages 552-555.
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J.M. Dyke, A. Morris, A.M.A. Ridha & J.G. Snijders. (1982) Gas phase high temperature photoelectron spectroscopy: The tin monoxide molecule. Chemical Physics 67:3, pages 245-253.
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J. A. Horsley. (1982) Relationship between the area of L 2,3 x-ray absorption edge resonances and the d orbital occupancy in compounds of platinum and iridium . The Journal of Chemical Physics 76:3, pages 1451-1458.
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S. Millefiori, A. Millefiori & G. Granozzi. (1981) Electronic structure of NS compounds. A CNDO study of transition metal thionitrosyl complexes Ni(S2N2H)2 and Pd(S2N2H)2. Inorganica Chimica Acta 48, pages 233-236.
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Salvatore Millefiori, Arcangelo Millefiori & C. D'Arrigo. (1981) Electronic structure of NS compounds. Ab initio and INDO/S-Cl investigation of S4N4H4. Inorganica Chimica Acta 50, pages 167-172.
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I. A. Topol'V. M. Kovba, N. F. Stepanov & A. S. Chesnyl. (1981) Theoretical and experimental investigation of the electronic spectra of tungsten chalcohalides. Theoretical and Experimental Chemistry 17:2, pages 130-135.
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I.A. Topol, A.S. Chesnyi, V.M. Kovba & N.F. Stepanov. (1980) Electron spectra and one-electron properties of the WOCl 4 , WSCl 4 and WOBr 4 molecules. Chemical Physics 53:1-2, pages 63-69.
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Igor A. Topol, Nikolaj F. Stepanov & Vasilij M. Kovba. (1980) Electronic structure and electronic absorption spectra of molybdenum and tungsten oxotetrachlorides. Theoretica Chimica Acta 56:4, pages 297-306.
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M. S. Gopinathan & M. A. Whitehead. (1980) On the Dependence of Total Energy on Occupation Numbers. Israel Journal of Chemistry 19:1-4, pages 209-214.
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. (2010) Theoretische Chemie 1978. Nachrichten aus Chemie, Technik und Laboratorium 27:2, pages 72-75.
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