An ab Initio Hartree−Fock Study of the Cubic and Tetragonal Phases of Bulk Tungsten Trioxide
- 1 January 1996
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of the American Chemical Society
- Vol. 118 (48) , 12174-12182
- https://doi.org/10.1021/ja961514u
Abstract
No abstract availableThis publication has 37 references indexed in Scilit:
- Theoretical investigations of the electronic properties of vanadium oxides. 1. Pseudopotential periodic Hartree-Fock study of vanadium pentoxide crystal latticeChemistry of Materials, 1993
- Order parameter and critical exponent for the pressure-induced phase transitions inPhysical Review B, 1986
- Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitalsThe Journal of Chemical Physics, 1985
- The activity of WO3-based mixed-oxide catalysts I. Acidic properties of WO3-based catalysts and correlation with catalytic activityJournal of Catalysis, 1977
- Special points for Brillouin-zone integrationsPhysical Review B, 1976
- A new type of electro-optic effect in semiconducting WO3Journal of Applied Crystallography, 1974
- Neutron diffraction investigation of WO3Acta Crystallographica, 1966
- The Preparation and Crystal Structure of Molybdenum (III) FluorideJournal of the American Chemical Society, 1960
- Compressibilities of the Alkali MetalsThe Journal of Chemical Physics, 1938
- Rheniumtrioxyd. II. MitteilungZeitschrift für anorganische und allgemeine Chemie, 1932