CNDO CI calculations on second-row molecules I. Phosphorin and thiophen
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Published in | Theoretica Chimica Acta Vol. 33; no. 1; pp. 19 - 28 |
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Main Authors | , |
Format | Journal Article |
Language | English |
Published |
01.03.1974
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Online Access | Get full text |
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Author | Schweig, Armin Schulte, Karl-Wilhelm |
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Cites_doi | 10.1007/BF00526540 10.1063/1.1668915 10.1039/c29700000319 10.1063/1.1701475 10.1007/BF01046363 10.1063/1.1669734 10.1063/1.1701476 10.1246/bcsj.42.933 10.1016/S0040-4039(01)84868-1 10.1016/0022-2860(72)80058-9 10.1088/0370-1298/65/4/118 10.1063/1.1699030 10.1039/JR9570003885 10.1063/1.1711841 10.1021/ja00973a008 10.1016/S0040-4039(00)99749-1 10.1021/jo50013a001 10.1021/j100839a501 10.1002/ange.19710831710 10.1021/ja00742a038 10.1016/0020-7381(71)80002-5 10.1063/1.1743138 10.1002/ange.19680802007 10.1016/S0031-8914(34)90011-2 10.1063/1.1727227 10.1021/ja00863a008 10.1021/ja00784a054 10.1524/zpch.1957.12.5_6.335 10.1016/S0040-4020(01)83050-7 10.1016/S0040-4020(01)82541-2 10.1063/1.1679498 10.1016/0022-2852(72)90222-6 10.1098/rspa.1941.0088 10.1016/S0371-1951(41)80160-X |
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References | G. Pfister-Guillouzo (CR5) 1972; 14 P.J. Derrik (CR10) 1971; 6 U Gelius (CR30) 1972; 27 J.A. Pople (CR13) 1966; 44 J. Bene Del (CR2) 1968; 48 G. Milazzo (CR35) 1944; 2 G. Milazzo (CR37) 1953; 83 R.L. Ellis (CR3) 1972; 26 A.J. Ashe (CR25) 1971; 93 D.T. Clark (CR7) 1970 T. Yonezawa (CR31) 1969; 42 J.A. Pople (CR11) 1965; 43 R.L. Kuczkowski (CR21) 1972; 42 J. Bene Del (CR1) 1968; 48 M.R. Padhye (CR41) 1952; A65 K. Nishimoto (CR18) 1957; 12 R.A.W. Johnstone (CR17) 1969; 25 D.P. Santry (CR14) 1967; 47 R. Pariser (CR16) 1953; 21 B. Bak (CR33) 1956; 25 CR6 J. Sicé (CR40) 1960; 64 CR29 D.T. Clark (CR9) 1968; 24 CR27 G. Milazzo (CR36) 1948; 78 CR22 C. Batich (CR24) 1973; 95 CR42 G. Kuehnlenz (CR4) 1973; 58 J.A. Pople (CR12) 1965; 43 G. Leandri (CR39) 1955; 85 M.J. Bielefeld (CR28) 1966; 88 F.S. Boig (CR38) 1953; 18 J. Hinze (CR15) 1962; 84 W.C. Price (CR34) 1941; A179 L. Brillouin (CR19) 1934 J.C.J. Bart (CR20) 1968; 80 B. Bak (CR32) 1961; 7 J.A. Pople (CR8) 1970 H. Oehling (CR23) 1971; 83 T. Koopmans (CR26) 1934; 1 |
References_xml | – volume: 26 start-page: 131 year: 1972 ident: CR3 publication-title: Theoret. Chim. Acta (Berl.) doi: 10.1007/BF00526540 contributor: fullname: R.L. Ellis – volume: 48 start-page: 1807 year: 1968 ident: CR1 publication-title: J. Chem. Phys. doi: 10.1063/1.1668915 contributor: fullname: J. Bene Del – volume: 7 start-page: 56 year: 1961 ident: CR32 publication-title: J. Mol. Spectr. contributor: fullname: B. Bak – ident: CR29 doi: 10.1039/c29700000319 – volume: 43 start-page: 129 year: 1965 ident: CR11 publication-title: J. Chem. Phys. doi: 10.1063/1.1701475 contributor: fullname: J.A. Pople – volume: 27 start-page: 171 year: 1972 ident: CR30 publication-title: Theoret. Chim. Acta (Berl.) doi: 10.1007/BF01046363 contributor: fullname: U Gelius – volume: 48 start-page: 4050 year: 1968 ident: CR2 publication-title: J. Chem. Phys. doi: 10.1063/1.1669734 contributor: fullname: J. Bene Del – volume: 43 start-page: 136 year: 1965 ident: CR12 publication-title: J. Chem. 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Padhye – volume: 21 start-page: 767 year: 1953 ident: CR16 publication-title: J. Chem. Phys. doi: 10.1063/1.1699030 contributor: fullname: R. Pariser – volume: 85 start-page: 769 year: 1955 ident: CR39 publication-title: Gazz. Chim. Ital. contributor: fullname: G. Leandri – ident: CR42 doi: 10.1039/JR9570003885 – volume: 47 start-page: 158 year: 1967 ident: CR14 publication-title: J. Chem. Phys. doi: 10.1063/1.1711841 contributor: fullname: D.P. Santry – volume: 88 start-page: 4804 year: 1966 ident: CR28 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja00973a008 contributor: fullname: M.J. Bielefeld – ident: CR22 doi: 10.1016/S0040-4039(00)99749-1 – volume: 18 start-page: 775 year: 1953 ident: CR38 publication-title: J. Org. Chem. doi: 10.1021/jo50013a001 contributor: fullname: F.S. Boig – volume: 64 start-page: 1572 year: 1960 ident: CR40 publication-title: J. Phys. Chem. doi: 10.1021/j100839a501 contributor: fullname: J. 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Brillouin – volume: 1 start-page: 104 year: 1934 ident: CR26 publication-title: Physica doi: 10.1016/S0031-8914(34)90011-2 contributor: fullname: T. Koopmans – volume-title: Organic compounds of sulphur, selenium, and tellurium, Specialist Periodical Reports year: 1970 ident: CR7 contributor: fullname: D.T. Clark – volume: 44 start-page: 3289 year: 1966 ident: CR13 publication-title: J. Chem. Phys. doi: 10.1063/1.1727227 contributor: fullname: J.A. Pople – volume: 84 start-page: 540 year: 1962 ident: CR15 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja00863a008 contributor: fullname: J. Hinze – volume: 95 start-page: 928 year: 1973 ident: CR24 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja00784a054 contributor: fullname: C. Batich – volume: 12 start-page: 335 year: 1957 ident: CR18 publication-title: Z. Physik.Chem. doi: 10.1524/zpch.1957.12.5_6.335 contributor: fullname: K. Nishimoto – volume: 25 start-page: 5485 year: 1969 ident: CR17 publication-title: Tetrahedron doi: 10.1016/S0040-4020(01)83050-7 contributor: fullname: R.A.W. Johnstone – volume: 24 start-page: 2663 year: 1968 ident: CR9 publication-title: Tetrahedron doi: 10.1016/S0040-4020(01)82541-2 contributor: fullname: D.T. Clark – volume: 58 start-page: 2238 year: 1973 ident: CR4 publication-title: J. Chem. Phys. doi: 10.1063/1.1679498 contributor: fullname: G. Kuehnlenz – volume: 42 start-page: 457 year: 1972 ident: CR21 publication-title: J. Mol. Spectr. doi: 10.1016/0022-2852(72)90222-6 contributor: fullname: R.L. Kuczkowski – volume: A179 start-page: 201 year: 1941 ident: CR34 publication-title: Proc. Roy. Soc. (Lond.) doi: 10.1098/rspa.1941.0088 contributor: fullname: W.C. Price – volume: 2 start-page: 245 year: 1944 ident: CR35 publication-title: Spectrochim. Acta doi: 10.1016/S0371-1951(41)80160-X contributor: fullname: G. Milazzo |
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Subtitle | I. Phosphorin and thiophen |
Title | CNDO CI calculations on second-row molecules |
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