Works matching IS 00207608 AND DT 1976 AND VI 10 AND IP 4

Results: 14

The simulated ab initio molecular orbital technique. VI. Open-shell radicals in the spin restricted formalism.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 629, doi. 10.1002/qua.560100407

By:

Collins, Michael P. S.;
Duke, Brian J.;
Eilers, James E.;
O'Leary, Brian

Publication type:

Article

Quantum chemical calculations on thioridazine.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 559, doi. 10.1002/qua.560100402

By:

Kaufman, Joyce J.;
Kerman, Ellen

Publication type:

Article

On the applicability of the selected valence electron split-shell method to ionic molecules.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 715, doi. 10.1002/qua.560100413

By:

Sannigrahi, A. B.;
Mohammad, S. Noor

Publication type:

Article

Calculation of j and jm symbols for arbitrary compact groups. III. Application to SO.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 615, doi. 10.1002/qua.560100406

By:

Butler, P. H.;
Wybourne, B. G.

Publication type:

Article

Masthead.

Published in:: International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. fmi, doi. 10.1002/qua.560100401
Publication type:: Article

Group theoretical classification of states of a molecular system at definite states of its constituent parts.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 699, doi. 10.1002/qua.560100412

By:

Kaplan, I. G.;
Rodimova, O. B.

Publication type:

Article

Calculation of j and jm symbols for arbitrary compact groups. II. An alternate procedure for angular momentum.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 599, doi. 10.1002/qua.560100405

By:

Butler, P. H.

Publication type:

Article

Spin-Orbit coupling in aromatic hydrocarbons: A semiempirical evaluation of the radiative lifetimes of naphtalene and anthracene.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 659, doi. 10.1002/qua.560100409

By:

Bendazzoli, G. L.;
Orlandi, G.;
Palmieri, P.

Publication type:

Article

A characterization of pairs of subspaces for quantum chemical applications of the Galerkin-Petrov method.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 683, doi. 10.1002/qua.560100411

By:

Jankowski, K.

Publication type:

Article

Calculation of j and jm symbols for arbitrary compact groups. I. Methodology.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 581, doi. 10.1002/qua.560100404

By:

Butler, P. H.;
Wybourne, B. G.

Publication type:

Article

A finite-difference approach to the electron correlation problem.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 643, doi. 10.1002/qua.560100408

By:

Fimple, W. R.;
Unwin, M. J.

Publication type:

Article

An interative scheme for electronic systems using one-electron green's functions.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 669, doi. 10.1002/qua.560100410

By:

Hyslop, J.;
Rees, D.

Publication type:

Article

Ab initio.

Published in:

International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 569, doi. 10.1002/qua.560100403

By:

Popkie, Herbert E.;
Kaufman, Joyce J.

Publication type:

Article

Announcements.

Published in:: International Journal of Quantum Chemistry, 1976, v. 10, n. 4, p. 717, doi. 10.1002/qua.560100414
Publication type:: Article