Sigma trans promotion effect in transition metal complexes: a manifestation of the composite nature of binding energy (English)
- New search for: Khoroshun, Dmitry V.
- New search for: Khoroshun, Dmitry V.
- New search for: Musaev, Djamaladdin G.
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In:
Molecular physics
;
100
, 4
; 523-532
;
2002
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ISSN:
- Article (Journal) / Print
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Title:Sigma trans promotion effect in transition metal complexes: a manifestation of the composite nature of binding energy
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Contributors:
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Published in:Molecular physics ; 100, 4 ; 523-532
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Publisher:
- New search for: Taylor & Francis
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Place of publication:London
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Publication date:2002
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ISSN:
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ZDBID:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 35.10 / 33.30 / 42.12
- Further information on Basic classification
- New search for: 275/3465
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Keywords:
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Source:
Table of contents – Volume 100, Issue 4
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 385
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Assessing isomeric structures of pincer-ligated ruthenium and osmium polyhydrides using density functional calculationsWATSON, LORI ANNE / CAULTON, KENNETH G. et al. | 2002
- 397
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An alternate derivation of the Herman—Kluk (coherent state) semiclassical initial value representation of the time evolution operatorMILLER, WILLIAM H. et al. | 2002
- 401
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An approximate exchange-correlation hole density as a functional of the natural orbitalsBUIJSE, M. A. / BAERENDS, E. J. et al. | 2002
- 423
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Density functional theory-based reactivity descriptors for dioxinsARULMOZHIRAJA, SUNDARAM / FUJII, TOSHIHIRO / SATO, GEN et al. | 2002
- 433
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Eigenvalues, integer discontinuities and NMR shielding constants in Kohn—Sham theoryALLEN, MARK J. / TOZER, DAVID J. et al. | 2002
- 441
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An analysis of the conformers of 1,5-hexadieneROCQUE, BRANDON G. / GONZALES, JASON M. / SCHAEFER, HENRY F.III et al. | 2002
- 447
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A full configuration interaction calculation of the density dependence of the 3He shielding constantPECUL, MAGDALENA / RIZZO, ANTONIO et al. | 2002
- 453
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The heats of formation of the haloacetylenes XCCY (X, YParthiban, Srinivasan et al. | 2002
- 453
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The heats of formation of the haloacetylenes XCCY [X, Y = H, F, Cl]: basis set limit ab initio results and thermochemical analysisPARTHIBAN, SRINIVASAN / MARTIN, JAN M. L. / LIEBMAN, JOEL F. et al. | 2002
- 465
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Study of Rydberg transitions in NaHeMARTÍN, I. / CHARRO, E. / LAVÍN, C. et al. | 2002
- 475
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Lifetimes of metastable spherical carbon cluster dianionsSHI, QICUN / KAIS, SABRE et al. | 2002
- 483
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Practical failures from the inclusion of exact exchange: how much exact exchange is appropriate?ORLOVA, GALINA / GODDARD, JOHN D. et al. | 2002
- 499
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A comparison of finite basis set and finite difference Hartree-Fock calculations for the open-shell (X2 S+) molecules BaF and YbFKobus, J. et al. | 2002
- 499
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A comparison of finite basis set and finite difference Hartree—Fock calculations for the open-shell (X 2Σ+) molecules BaF and YbFKOBUS, J. / MONCRIEFF, D. / WILSON, S. et al. | 2002
- 509
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The electronic spectrum of chloromethanol ClCH2OH in comparison with isomeric methylhypochlorite CH3OClMÜHLHÄUSER, MAX / SCHNELL, MELANIE / PEYERIMHOFF, SIGRID D. et al. | 2002
- 517
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Electronic structures of osmium dinitrides and dinitrogen molecule activation by the osmium atomCAO, ZEXING / WU, WEI / ZHANG, QIANER et al. | 2002
- 523
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Sigma trans promotion effect in transition metal complexes: a manifestation of the composite nature of binding energyKHOROSHUN, DMITRY V. / MUSAEV, DJAMALADDIN G. / MOROKUMA, KEIJI et al. | 2002
- 533
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Comparison of a CH and CF activation in alkyl transition metal complexes: a DFT and CASSCF studyGérard, Hélène et al. | 2002
- 533
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Comparison of α CH and CF activation in alkyl transition metal complexes: a DFT and CASSCF studyGÉRARD, HÉLÈNE / DAVIDSON, ERNEST R. / EISENSTEIN, ODILE et al. | 2002
- ebi
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Editorial Board| 2002