Vote for your favorite mineral in #MinCup25! - Pectolite vs. Haüyne
It's a pair of striking blue beauties as #pectolite the uncrushable faces off against #hauyne, the phoenix from volcanic ashes!
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

Bene, Janet E. Del, Ditchfield, R., Pople, J. A. (1971) Self‐Consistent Molecular Orbital Methods. X. Molecular Orbital Studies of Excited States with Minimal and Extended Basis Sets. The Journal of Chemical Physics, 55 (5) 2236-2241 doi:10.1063/1.1676398

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleSelf‐Consistent Molecular Orbital Methods. X. Molecular Orbital Studies of Excited States with Minimal and Extended Basis Sets
JournalThe Journal of Chemical Physics
AuthorsBene, Janet E. DelAuthor
Ditchfield, R.Author
Pople, J. A.Author
Year1971 (September)Volume55
Issue5
PublisherAIP Publishing
DOIdoi:10.1063/1.1676398Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2079332Long-form Identifiermindat:1:5:2079332:4
GUID0
Full ReferenceBene, Janet E. Del, Ditchfield, R., Pople, J. A. (1971) Self‐Consistent Molecular Orbital Methods. X. Molecular Orbital Studies of Excited States with Minimal and Extended Basis Sets. The Journal of Chemical Physics, 55 (5) 2236-2241 doi:10.1063/1.1676398
Plain TextBene, Janet E. Del, Ditchfield, R., Pople, J. A. (1971) Self‐Consistent Molecular Orbital Methods. X. Molecular Orbital Studies of Excited States with Minimal and Extended Basis Sets. The Journal of Chemical Physics, 55 (5) 2236-2241 doi:10.1063/1.1676398
In(1971, September) The Journal of Chemical Physics Vol. 55 (5) AIP Publishing

See Also

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

Bene, Janet E. Del, Pople, J. A. (1971) Theory of Molecular Interactions. II. Molecular Orbital Studies of HF Polymers Using a Minimal Slater‐Type Basis. The Journal of Chemical Physics, 55 (5) 2296-2299 doi:10.1063/1.1676408
Ditchfield, R., Hehre, W. J., Pople, J. A. (1971) Self‐Consistent Molecular‐Orbital Methods. IX. An Extended Gaussian‐Type Basis for Molecular‐Orbital Studies of Organic Molecules. The Journal of Chemical Physics, 54 (2) 724-728 doi:10.1063/1.1674902
Hehre, W. J., Ditchfield, R., Pople, J. A. (1972) Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic Molecules. The Journal of Chemical Physics, 56 (5) 2257-2261 doi:10.1063/1.1677527
Hehre, W. J., Ditchfield, R., Pople, J. A. (1970) Self‐Consistent Molecular‐Orbital Methods. VIII. Molecular Studies with Least Energy Minimal Atomic Orbitals. The Journal of Chemical Physics, 53 (3) 932-935 doi:10.1063/1.1674159
Ditchfield, R., Miller, D. P., Pople, J. A. (1971) Self‐Consistent Molecular Orbital Methods. XI. Molecular Orbital Theory of NMR Chemical Shifts. The Journal of Chemical Physics, 54 (10) 4186-4193 doi:10.1063/1.1674657
Del Bene, Janet E., Pople, J. A. (1973) Theory of molecular interactions. III. A comparison of studies of H2O polymers using different molecular‐orbital basis sets. The Journal of Chemical Physics, 58 (9) 3605-3608 doi:10.1063/1.1679707
Del Bene, Janet, Pople, J. A. (1970) Theory of Molecular Interactions. I. Molecular Orbital Studies of Water Polymers Using a Minimal Slater‐Type Basis. The Journal of Chemical Physics, 52 (9) 4858-4866 doi:10.1063/1.1673723
Dill, James D., Pople, John A. (1975) Self‐consistent molecular orbital methods. XV. Extended Gaussian‐type basis sets for lithium, beryllium, and boron. The Journal of Chemical Physics, 62 (7) 2921-2923 doi:10.1063/1.430801
Newton, Marshall D., Lathan, W. A., Hehre, W. J., Pople, J. A. (1969) Self‐Consistent Molecular‐Orbital Methods. III. Comparison of Gaussian Expansion and PDDO Methods Using Minimal STO Basis Sets. The Journal of Chemical Physics, 51 (9) 3927-3932 doi:10.1063/1.1672611
Ditchfield, R., Hehre, W. J., Pople, J. A. (1970) Self‐Consistent Molecular Orbital Methods. VI. Energy Optimized Gaussian Atomic Orbitals. The Journal of Chemical Physics, 52 (10) 5001-5007 doi:10.1063/1.1672736
Hehre, W. J., Pople, J. A. (1972) Self‐Consistent Molecular Orbital Methods. XIII. An Extended Gaussian‐Type Basis for Boron. The Journal of Chemical Physics, 56 (8) 4233-4234 doi:10.1063/1.1677844
 
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 17, 2025 18:47:49
Go to top of page