Works matching IS 00207608 AND DT 1981 AND VI 20 AND IP 6

Results: 23

Reactive Intermediates in the Gas Phase, Generation and Monitoring. Edited by D. W. Setser. Academic, New York, 1979.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1333, doi. 10.1002/qua.560200620

By:

Siegbah, Hans

Publication type:

Article

A posteriori symmetry analysis of polymer electronic band structures.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1143, doi. 10.1002/qua.560200602

By:

Božović, I. B.;
Delhalle, J.;
Damnjanović, M.

Publication type:

Article

Cluster expansion of the wave function. Electron correlations in singlet and triplet excited states, ionized states, and electron attached states by.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1301, doi. 10.1002/qua.560200613

By:

Nakatsuji, Hiroshi;
Hirao, Kimihiko

Publication type:

Article

Computer-generated formulas for two-center coulomb integrals over slater- type orbitals.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1217, doi. 10.1002/qua.560200606

By:

Jones, Herbert W.

Publication type:

Article

Quantum Theory of Polymers. Edited by J.-M. André, J. Delhalle, and J. Ladik. NATO advanced study Institutes series C, Volume 39. Reidle, Dordrecht and Boston, 1978.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1332, doi. 10.1002/qua.560200617

By:

Calais, Jeans-Louis

Publication type:

Article

Masthead.

Published in:: International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. fmi, doi. 10.1002/qua.560200601
Publication type:: Article

Exponential transformation of molecular orbitals. II. General formulation for UHF calculations and application to diatomics and molecular fragments.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1285, doi. 10.1002/qua.560200612

By:

Bruceñta, A.;
Vermeulin, P.;
Archirel, P.;
Berthier, G.

Publication type:

Article

Announcement.

Published in:: International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1337, doi. 10.1002/qua.560200623
Publication type:: Article

Simple derivation of conditions for instability in the Hartree-Fock and projected Hartree-Fock schemes.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1201, doi. 10.1002/qua.560200605

By:

Löwdin, Per-olov;
Calais, Jean-Louis;
Calazans, Jacques M.

Publication type:

Article

Chime quantiwue structural et ét éléments de spectroscopie théorique. By A. Julg. Office des publications universitaires, Alger, 1978.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1331, doi. 10.1002/qua.560200616

By:

Calais, Jean-Louis

Publication type:

Article

Connections between perturbation theory and the unitary transformation methods of deriving effective Hamiltonians.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1243, doi. 10.1002/qua.560200609

By:

Westhaus, Paul

Publication type:

Article

Variants of Rayleigh-Schrödinger perturbation theory-a new look.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1273, doi. 10.1002/qua.560200611

By:

Bhattacharyya, Kamal

Publication type:

Article

Ab Znitio Calculations-Methods and Applications in Chemistry. By Peter CBrsky and Miroslav Urban. Lecture Notes in Chemistry No. 16. Springer-Verlag, Berlin, 1980. ISBN 3-540-10005-9.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1334, doi. 10.1002/qua.560200622

By:

Froelic, Piotr

Publication type:

Article

Structure and spin-purity conditions for reduced density matrices of arbitrary order.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1179, doi. 10.1002/qua.560200604

By:

Luzanov, A. V.;
Whyman, G. E.

Publication type:

Article

Catalysis in chemistry and biochemistry. Theory and experiment-jerusalem symposia on quantum chemistry and biochemistry. Vol. 12. Edited by B. Pullman. Reidel, dordrecht, 1979. Prie (cloth): $85.00. ISBN 90-277-10399-2.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1331, doi. 10.1002/qua.560200615

By:

Larsson, Seven;
Mȧrtensson, Olle

Publication type:

Article

Ordered products of exponential operators by similarity transformations.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1233, doi. 10.1002/qua.560200608

By:

Witschel, W.

Publication type:

Article

Reactive Intermediates in the Gas Phase, Generation and Monitoring. Edited by D. W. Setser. Academic, New York, 1979.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1333, doi. 10.1002/qua.560200619

By:

Siegbah, Hans

Publication type:

Article

Carcinogenesis: Fundamental Mechanisms and Environmental Effects. Edited by B. Pullman, P.O.P. Ts'o, and H. Gelboin. The Jerusalem Symposia on Quantum Chemistry and Biochemistry. Vol. 13. Reidel, Dordrecht, 1980. ISBN 90-277-1171-2.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1334, doi. 10.1002/qua.560200621

By:

Martensson, Olle

Publication type:

Article

Symmetry simplifications of space types in configuration interaction induced by orbital degeneracy.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1255, doi. 10.1002/qua.560200610

By:

Balasubramanian, K.

Publication type:

Article

A hybrid technique of orthonormality constrained orbital optimization in.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1165, doi. 10.1002/qua.560200603

By:

PrasadBhattacharyya, Sankar;
Mukherjee, Debashis

Publication type:

Article

Internal stresses and chemical binding in the H.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1315, doi. 10.1002/qua.560200614

By:

Bamzai, Anjuli S.;
Deb, B. M.

Publication type:

Article

Catecholamine interaction with anionic sites-A model study.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1225, doi. 10.1002/qua.560200607

By:

ŠOlmajer, T.;
Kocjan, D.;
Hadži, D.

Publication type:

Article

Electrons and Phonom in Layered Crystal Shuctures Edited by T. J. Wietling and M. Schluter. Physics and Chemistry of Materials with Layered Structures, Volume 3 D. Reidel, Dordrecht and Boston, 1979.

Published in:

International Journal of Quantum Chemistry, 1981, v. 20, n. 6, p. 1332, doi. 10.1002/qua.560200618

By:

Calai, Jean-Louis

Publication type:

Article