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Hartree-fock-slater method for materials science: the DV-X alpha method for design and characterization of materials
Molecular-orbital calculations for materials design such as alloys, ceramics, and coordination compounds are now possible for experimentalists. Molecuar-orbital calculations for the interpretation of chemical effect of spectra are also possible for experimentalists. The most suitable molecular-orbit...
| Autores principales: | , , |
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| Lenguaje: | eng |
| Publicado: |
Springer
2006
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| Materias: | |
| Acceso en línea: | https://dx.doi.org/10.1007/3-540-31297-8 http://cds.cern.ch/record/1991450 |