Theoretical Chemistry Accounts,volume 120,issue 1-3  (05-2014)

Period of time： 2014年1-3期

Publisher： Springer Publishing Company

Founded in： 1962

Total resources： 25

ISSN： 1432-881X

Subject： O6 Chemistry

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Theoretical Chemistry Accounts,volume 120,issue 1-3

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Mark S. Gordon

By Baldridge Kim in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 1-4

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A microsolvation approach to the prediction of the relative enthalpies and free energies of hydration for ammonium ions

By Merrill G. in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 5-22

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Calculating molecular vibrational spectra beyond the harmonic approximation

By Lin Ching in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 23-35

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Improved wood-kirkwood detonation chemical kinetics

By Glaesemann Kurt in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 37-43

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Structure, vibrational frequencies, ionization energies, and photoelectron spectrum of the para-benzyne radical anion

By Vanovschi Vitalii in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 45-58

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Application of renormalized coupled-cluster methods to potential function of water

By Piecuch Piotr in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 59-78

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Cluster study of surface radicals of Si(111)-7 × 7 reconstructed surface

By Lee Hee in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 79-83

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Tetra-hydrides of the third-row transition elements: spin-orbit coupling effects on geometrical deformation in WH 4 and OsH 4

By Hisashima Taka-aki in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 85-94

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Quantum chemical prediction of the 13 C NMR shifts in alkyl and chlorocorannulenes: correction of chlorine effects

By Baldridge Kim in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 95-106

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Kinetics of the hydrogen abstraction CHO + Alkane

By Huynh Lam in (2008)

Theoretical Chemistry Accounts,volume 120,issue 1-3 , Vol. 120, Iss. 1-3, 2008-05 , pp. 107-118

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