CRYSTALFF--from crystallography to EXAFS multiple-scattering calculations with FEFF
CRYSTALFF is an alternative utility to ATOMS containing most of the features of this standard program for converting crystallographic data to FEFF input. In addition, it offers an interface with molecular modelling programs via the PDB format and new coordination sphere analysis options
| Veröffentlicht in: | Journal of synchrotron radiation. - 1999. - 8(2001), 4 vom: 01. Juli, Seite 1109-12 |
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| Format: | Aufsatz |
| Sprache: | English |
| Veröffentlicht: |
2001
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| Zugriff auf das übergeordnete Werk: | Journal of synchrotron radiation |
| Schlagworte: | Journal Article |
| Zusammenfassung: | CRYSTALFF is an alternative utility to ATOMS containing most of the features of this standard program for converting crystallographic data to FEFF input. In addition, it offers an interface with molecular modelling programs via the PDB format and new coordination sphere analysis options |
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| Beschreibung: | Date Completed 23.08.2001 Date Revised 05.06.2019 published: Print Citation Status PubMed-not-MEDLINE |
| ISSN: | 0909-0495 |