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Electronic correlations and polarizability of the Thomas-Fermi-Dirac-Amaldi potential : applications to the singly ionized iron-peak speciesBAUTISTA, Manuel A.Journal of physics. B. Atomic, molecular and optical physics (Print). 2008, Vol 41, Num 6, issn 0953-4075, 065701.1-065701.8Article
Two-temperature model of compressed atoms in a dense plasmaFURUTANI, Y; FUKUYAMA, A; HAYASHI, T et al.Journal of the Physical Society of Japan. 1996, Vol 65, Num 8, pp 2463-2471, issn 0031-9015Article
Prediction of molecular Auger rates using a statistical modelWALSH, T. R; MEEHAN, T. E; LARKINS, F. P et al.Journal of physics. B. Atomic, molecular and optical physics (Print). 1994, Vol 27, Num 11, pp 2211-2216, issn 0953-4075Article
Simple modification of Thomas-Fermi theoryDEB, B. M; RANBIR SINGH; SEMWAL, R. P et al.Journal of physics. B. Atomic, molecular and optical physics (Print). 1993, Vol 26, Num 20, pp 3447-3457, issn 0953-4075Article
Atoms in the magnetic field of a neutron starLIEB, E. H; SOLOVEJ, J. P.Mathematics in science and engineering. 1993, Vol 192, pp 221-237, issn 0076-5392Article
Energy equation of state' of high-density plasmasPFALZNER, S.Applied physics. B, Photophysics and laser chemistry. 1991, Vol 52, Num 3, pp 230-233, issn 0721-7269Article
Atomic calculations through a modified Thomas-Fermi-Dirac-Weizsäcker theoryGLOSSMAN, M. D; CASTRO, E. A.Zeitschrift für Physik. D, atoms, molecules and clusters. 1989, Vol 13, Num 2, pp 89-93, issn 0178-7683, 5 p.Article
Thomas-Fermi theory from a perturbative treatment of the hydrogenic limit energy density functional: a possible link to local density functional theoryBARTOLOTTI, L. J; PARR, R. G; TAL, Y et al.International journal of quantum chemistry. 1988, Vol 34, Num 6, pp 509-515, issn 0020-7608Article
Modified Thomas-Fermi model applied to diamagnetic susceptibilities of crystal ionsKUCHARCZYK, M; OLSZEWSKI, S.Physica status solidi. B. Basic research. 1987, Vol 140, Num 2, pp K141-K144, issn 0370-1972Article
On the leading energy correction for the statistical model of the atom: interacting caseSIEDENTOP, H; WEIKARD, R.Communications in mathematical physics. 1987, Vol 112, Num 3, pp 471-490, issn 0010-3616Article
A parametrization of the TFDW density for atoms and diatomic quasimoleculesSCHEIDEMANN, A; DREIZLER, R. M.Zeitschrift für Physik D. Atoms, molecules and clusters. 1986, Vol 2, Num 1, pp 43-47Article
Density functional theory of the chemical potential of atoms and its relation to electrostatic potentials and bonding distancesBALBAS, L. C; ALONSO, J. A; VEGA, L. A et al.Zeitschrift für Physik D. Atoms, molecules and clusters. 1986, Vol 1, Num 2, pp 214-221Article
Migratory aptitude of hydride and methyl toward carbon monoxide, thiocarbonyl, and carbene in RMn(CO)4XY (XY = CO, CS, CH2; R = H, CH3): a theoretical study by the Hartree―Fock―Slater transition-state methodZIEGLER, T; VERSLUIS, L; TSCHINKE, V et al.Journal of the American Chemical Society. 1986, Vol 108, Num 4, pp 612-617, issn 0002-7863Article
Theoretical evidence for a paramagnetic ground state of the cluster ion [(η5-C5Me5)3Re3(μ2-O)6]2+HOFMANN, P; RÖSCH, N.Journal of the Chemical Society. Chemical communications. 1986, Num 11, pp 843-844, issn 0022-4936Article
Distribution de la charge dans les ions négatifs d'atomes alcalinsGOLOVINSKIJ, P. A; KIYAN, I. YU.Optika i spektroskopiâ. 1986, Vol 60, Num 6, pp 1297-1298, issn 0030-4034Article
Discrete variational Xα studies of core excitation, photoemission, and inverse photoemission for CO and NiCO clustersKOJIMA, I; SRIVASTAVA, A. K; MIYAZAKI, E et al.The Journal of chemical physics. 1986, Vol 84, Num 8, pp 4455-4461, issn 0021-9606Article
Generalized exchange local-spin-density-functional theory: introduction and theoryMANOLI, S; WHITEHEAD, M. A.Physical review. A, General physics. 1986, Vol 34, Num 6, pp 4629-4640, issn 0556-2791Article
Calcul des énergies des états électroniques des fluorures de titane par la méthode SCF Xα SWPOLYAKOV, V. I; TOPOL, I. A; KUL'ZHANOV, A. T et al.Žurnal fizičeskoj himii. 1986, Vol 60, Num 3, pp 651-657, issn 0044-4537Article
Geometry optimization using local density functional methodsDUNLAP, B. I.Journal of physical chemistry (1952). 1986, Vol 90, Num 22, pp 5524-5529, issn 0022-3654Conference Paper
A new functional with homogeneous coordinate scaling in density functional theory: F[π,Ρl]LEVY, M; YANG, W; PARR, R. G et al.The Journal of chemical physics. 1985, Vol 83, Num 5, pp 2334-2336, issn 0021-9606Article
Local behavior of the kinetic energy in density functional theoryZORITA, M. L; ALONSO, J. A; BALBAS, L. C et al.International journal of quantum chemistry. 1985, Vol 27, Num 4, pp 393-406, issn 0020-7608Article
Self-consistent-field-Xα-scattered-wave molecular orbital calculation of [CpMoS(μ-S)]2, a molecule that undergoes a photochemically induced isomerizationBRUCE, M. R. M; BRUCE, A. E; TYLER, D. R et al.Polyhedron. 1985, Vol 4, Num 12, pp 2073-2081, issn 0277-5387Article
Theoretical study on the quadruple metal bond in d4-d4 binuclear tetracarboxylate complexes of chromium, molybdenum, and tungsten by the Hartree-Fock-Slater transition-state methodZIEGLER, T.Journal of the American Chemical Society. 1985, Vol 107, Num 15, pp 4453-4459, issn 0002-7863Article
Two-dimensional, fully numerical molecular calculations. VIII: Electric field gradients of diatomic hydrides LiH-ClH at the HFS levelSUNDHOLM, D; PYYKKO, P; LAAKSONEN, L et al.Molecular physics (Print). 1985, Vol 55, Num 3, pp 627-635, issn 0026-8976Article
Basis set effects on the electron density and spectroscopic properties of COBAERENDS, E. J; VERNOOIJS, P; ROZENDAAL, A et al.Journal of molecular structure. 1985, Vol 133, pp 147-159, issn 0022-2860Article
