Vote for your favorite mineral in #MinCup25! - Kosmochlor vs. Azurite
It's a battle of green vs blue as rare but vibrant chromium-bearing kosmochlor up against the deep blue copper alteration mineral azurite.
Log InRegister
Quick Links : The Mindat ManualThe Rock H. Currier Digital LibraryMindat Newsletter [Free Download]
Home PageAbout MindatThe Mindat ManualHistory of MindatCopyright StatusWho We AreContact UsAdvertise on Mindat
Donate to MindatCorporate SponsorshipSponsor a PageSponsored PagesMindat AdvertisersAdvertise on Mindat
Learning CenterWhat is a mineral?The most common minerals on earthInformation for EducatorsMindat ArticlesThe ElementsThe Rock H. Currier Digital LibraryGeologic Time
Minerals by PropertiesMinerals by ChemistryAdvanced Locality SearchRandom MineralRandom LocalitySearch by minIDLocalities Near MeSearch ArticlesSearch GlossaryMore Search Options
Search For:
Mineral Name:
Locality Name:
Keyword(s):
 
The Mindat ManualAdd a New PhotoRate PhotosLocality Edit ReportCoordinate Completion ReportAdd Glossary Item
Mining CompaniesStatisticsUsersMineral MuseumsClubs & OrganizationsMineral Shows & EventsThe Mindat DirectoryDevice SettingsThe Mineral Quiz
Photo SearchPhoto GalleriesSearch by ColorNew Photos TodayNew Photos YesterdayMembers' Photo GalleriesPast Photo of the Day GalleryPhotography

Pueyo, L., Richardson, J. W. (1977) Optical spectrum of Cr3+in octahedral fluoride lattices: Refinements on an open‐shell SCF MO calculation. The Journal of Chemical Physics, 67 (8) 3583-3591 doi:10.1063/1.435357

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleOptical spectrum of Cr3+in octahedral fluoride lattices: Refinements on an open‐shell SCF MO calculation
JournalThe Journal of Chemical Physics
AuthorsPueyo, L.Author
Richardson, J. W.Author
Year1977 (October 15)Volume67
Issue8
PublisherAIP Publishing
DOIdoi:10.1063/1.435357Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2113283Long-form Identifiermindat:1:5:2113283:0
GUID0
Full ReferencePueyo, L., Richardson, J. W. (1977) Optical spectrum of Cr3+in octahedral fluoride lattices: Refinements on an open‐shell SCF MO calculation. The Journal of Chemical Physics, 67 (8) 3583-3591 doi:10.1063/1.435357
Plain TextPueyo, L., Richardson, J. W. (1977) Optical spectrum of Cr3+in octahedral fluoride lattices: Refinements on an open‐shell SCF MO calculation. The Journal of Chemical Physics, 67 (8) 3583-3591 doi:10.1063/1.435357
In(1977, October) The Journal of Chemical Physics Vol. 67 (8) AIP Publishing

See Also

These are possibly similar items as determined by title/reference text matching only.

Pueyo, L., Richardson, J. W. (1977) Improved calculation of electronic excitation energies of transition‐metal compounds by a correlation energy correction: Application to CrF63− and NiF64−. The Journal of Chemical Physics, 67 (8) 3577-3582 doi:10.1063/1.435334
Pueyo, L., Richardson, J. W. (1981) Erratum: Improved calculation of electronic excitation energies of transition‐metal compounds by a correlation energy correction: Application to CrF63− and NiF64− [J. Chem. Phys. 67, 3577 (1977)]. The Journal of Chemical Physics, 74 (3) 2081 doi:10.1063/1.441768
Richardson, James W. (1961) Double‐ζ SCF MO Calculation of the Ground and Some Excited States of N2. The Journal of Chemical Physics, 35 (5) 1829-1839 doi:10.1063/1.1732152
Tossell, J. A. (1977) SCF–Xα scattered wave MO studies of the electronic structure of ferrous iron in octahedral coordination with sulfur. The Journal of Chemical Physics, 66 (12) 5712-5719 doi:10.1063/1.433845
Fernández Rodrigo, G., Pueyo, L. (1987) Electronic structure of Cr+, Fe+, and Ni+ in octahedral fluoride lattices. Journal de Chimie Physique, 84. 821-827 doi:10.1051/jcp/1987840821
Harrison, S. W., Fischer, C. R. (1971) LCAO‐MO‐SCF Calculation of the Formation Energy of Interstitial He in LiH. The Journal of Chemical Physics, 54 (8) 3653-3655 doi:10.1063/1.1675401
Sanz, J., Stone, W. E. E. (1977) NMR study of micas. I. Distribution of Fe2+ ions on the octahedral sites. The Journal of Chemical Physics, 67 (8) 3739-3743 doi:10.1063/1.435314
Mucci, Joseph F., Orloff, Malcolm K., Fitts, Donald D. (1965) Open‐Shell SCF—LCAO—MO Calculations on Polyazine Anions. The Journal of Chemical Physics, 42 (5) 1841-1842 doi:10.1063/1.1696202
Buenker, Robert J., Whitten, J. L., Petke, J. D. (1968) Ab Initio SCF MO and CI Calculations on the Electronic Spectrum of Benzene. The Journal of Chemical Physics, 49 (5) 2261-2267 doi:10.1063/1.1670394
Schaad, L. J., Robinson, B. H., Hess, B. A. (1977) The relation between orbital SCF energies and total SCF energies in molecules. The Journal of Chemical Physics, 67 (10) 4616-4617 doi:10.1063/1.434624
Wood, D. L., Ferguson, J., Knox, K., Dillon, J. F. (1963) Crystal‐Field Spectra ofd3,7Ions. III. Spectrum of Cr3+in Various Octahedral Crystal Fields. The Journal of Chemical Physics, 39 (4) 890-898 doi:10.1063/1.1734388
 
and/or  
Mindat.org is an outreach project of the Hudson Institute of Mineralogy, a 501(c)(3) not-for-profit organization.
Copyright © mindat.org and the Hudson Institute of Mineralogy 1993-2025, except where stated. Most political location boundaries are © OpenStreetMap contributors. Mindat.org relies on the contributions of thousands of members and supporters. Founded in 2000 by Jolyon Ralph.
To cite: Ralph, J., Von Bargen, D., Martynov, P., Zhang, J., Que, X., Prabhu, A., Morrison, S. M., Li, W., Chen, W., & Ma, X. (2025). Mindat.org: The open access mineralogy database to accelerate data-intensive geoscience research. American Mineralogist, 110(6), 833–844. doi:10.2138/am-2024-9486.
Privacy Policy - Terms & Conditions - Contact Us / DMCA issues - Report a bug/vulnerability Current server date and time: September 9, 2025 09:15:59
Go to top of page