Works matching IS 00207608 AND DT 1995 AND VI 56 AND IP 4

Results: 29

Some efforts beyond the local density approximation.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 345, doi. 10.1002/qua.560560420

By:

Sham, L. J.

Publication type:

Article

Proceedings of the satellite symposium on 'thirty years of density functional theory: Concepts and applications' (Cracow, June 13-16, 1994).

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 197, doi. 10.1002/qua.560560402

By:

Nalewajski, Roman F.

Publication type:

Article

Local-scaling transformation version of density functional theory.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 285, doi. 10.1002/qua.560560413

By:

Ludeña, Eduardo V.;
López-boada, Roberto;
Maldonado, Jorge E.;
Valderrama, Elmer;
Kryachko, Eugene S.;
Koga, Toshikatsu;
Hinze, Juergen

Publication type:

Article

New exact relations for improving the exchange and correlation potentials.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 385, doi. 10.1002/qua.560560424

By:

Levy, Mel;
Görling, Andreas

Publication type:

Article

Coordinate scaling and adiabatic connection formula for ensembles of fractionally occupied excited states.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 225, doi. 10.1002/qua.560560406

By:

Nagy, Á.

Publication type:

Article

Density functionals for the Yukawa electron-electron interaction.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 327, doi. 10.1002/qua.560560417

By:

Savin, Andreas;
Flad, Heinz-Jürgen

Publication type:

Article

Erratum.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 421, doi. 10.1002/qua.560560428

By:

Santamaria, R.;
Kaplan, I. G.;
Novaro, O.

Publication type:

Article

Masthead.

Published in:: International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. fmi, doi. 10.1002/qua.560560401
Publication type:: Article

The work formalism of electronic structure.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 265, doi. 10.1002/qua.560560412

By:

Sahni, Viraht

Publication type:

Article

Exact theorems concerning noninteracting kinetic energy density functional in D dimensions and their implications for gradient expansions.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 371, doi. 10.1002/qua.560560423

By:

Holas, A.;
March, N. H.

Publication type:

Article

Density functional theory of field theoretical systems.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 217, doi. 10.1002/qua.560560405

By:

Engel, E.

Publication type:

Article

On the relation between electronic and nuclear vibrations via the response matrix derived from semiempirical density functional-based sensitivity analysis.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 317, doi. 10.1002/qua.560560416

By:

Janssens, Geert O. A.;
Baekelandt, Bart G.;
Toufar, Helge;
Mortier, Wilfried J.;
Schoonheydt, Robert A.

Publication type:

Article

Chemistry and the near-sighted nature of the one-electron density matrix.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 409, doi. 10.1002/qua.560560427

By:

Bader, Richard F. W.

Publication type:

Article

Decay of charged stabilized jellium clusters.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 239, doi. 10.1002/qua.560560409

By:

Vieira, Armando;
Brajczewska, Marta;
Fiolhais, Carlos

Publication type:

Article

Subtle energies in density functional theory: Correlation and molecular dissociation.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 257, doi. 10.1002/qua.560560411

By:

March, N. H.

Publication type:

Article

Correlation strength and information entropy.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 363, doi. 10.1002/qua.560560422

By:

Ziesche, Paul

Publication type:

Article

The Principle of maximum physical hardness.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 211, doi. 10.1002/qua.560560404

By:

Pearson, Ralph G.

Publication type:

Article

On the test of different atomic exchange functionals.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 307, doi. 10.1002/qua.560560415

By:

Santamaria, R.;
Kaplan, I. G.;
Novaro, O.

Publication type:

Article

Average local electrostatic potential and the core-valency separation in atoms.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 399, doi. 10.1002/qua.560560426

By:

Sen, K. D.;
Gayatri, T. V.;
Krishnaveni, R.;
Kakkar, M.;
Toufar, Helge;
Janssens, Geert O. A.;
Baekelandt, Bart G.;
Schoonheydt, Robert A.;
Mortier, Wilfried J.

Publication type:

Article

Density functional theory and self-dual phase-space representations of quantum mechanics.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 233, doi. 10.1002/qua.560560408

By:

Włodarz, Joachim J.

Publication type:

Article

Density functional.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 337, doi. 10.1002/qua.560560419

By:

Zupan, Aleš;
Causà, Mauro

Publication type:

Article

Density functional theory including Van Der Waals forces.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 247, doi. 10.1002/qua.560560410

By:

Lundqvist, B. I.;
Andersson, Y.;
Shao, H.;
Chan, S.;
Langreth, D. C.

Publication type:

Article

On the gradient expansion of the exchange energy within linear response theory and beyond.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 351, doi. 10.1002/qua.560560421

By:

Svendsen, P. S.;
Von Barth, U.

Publication type:

Article

Real-space analysis of the exchange-correlation energy.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 199, doi. 10.1002/qua.560560403

By:

Burke, Kieron;
Perdew, John P.

Publication type:

Article

Spin-unrestricted character of Kohn-Sham orbitals for open-shell systems.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 303, doi. 10.1002/qua.560560414

By:

Pople, John A.;
Gill, Peter M. W.;
Handy, Nicholas C.

Publication type:

Article

A nonequilibrium time-dependent functional theory based on Liouvillean quantum field dynamics.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 389, doi. 10.1002/qua.560560425

By:

Rajagopal, A. K.;
Buot, F. A.

Publication type:

Article

Density functional theory for systems of very many atoms.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 229, doi. 10.1002/qua.560560407

By:

Kohn, W.

Publication type:

Article

Density functional theory for excited states.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. 333, doi. 10.1002/qua.560560418

By:

Theophilou, Andreas K.;
Gidopoulos, Nikitas I.

Publication type:

Article

Announcement.

Published in:

International Journal of Quantum Chemistry, 1995, v. 56, n. 4, p. I, doi. 10.1002/qua.560560429

By:

Parr, Robert G.

Publication type:

Article