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

Nemukhin, A. V., Weinhold, F. (1993) Boron oxides:Ab initiostudies with natural bond orbital analysis. The Journal of Chemical Physics, 98 (2). 1329-1335 doi:10.1063/1.464299

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleBoron oxides:Ab initiostudies with natural bond orbital analysis
JournalThe Journal of Chemical Physics
AuthorsNemukhin, A. V.Author
Weinhold, F.Author
Year1993 (January 15)Volume98
Issue2
PublisherAIP Publishing
DOIdoi:10.1063/1.464299Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2201900Long-form Identifiermindat:1:5:2201900:4
GUID0
Full ReferenceNemukhin, A. V., Weinhold, F. (1993) Boron oxides:Ab initiostudies with natural bond orbital analysis. The Journal of Chemical Physics, 98 (2). 1329-1335 doi:10.1063/1.464299
Plain TextNemukhin, A. V., Weinhold, F. (1993) Boron oxides:Ab initiostudies with natural bond orbital analysis. The Journal of Chemical Physics, 98 (2). 1329-1335 doi:10.1063/1.464299
In(1993, January) The Journal of Chemical Physics Vol. 98 (2) AIP Publishing

See Also

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

Nemukhin, A. V., Weinhold, F. (1992) Structures of the aluminum oxides studied by ab initio methods with natural bond orbital analysis. The Journal of Chemical Physics, 97 (5). 3420-3430 doi:10.1063/1.462978
Nemukhin, A. V., Weinhold, F. (1992) Natural bond orbitals in multiconfigurational expansions: Local treatment of electron correlation in molecules. The Journal of Chemical Physics, 97 (2). 1095-1108 doi:10.1063/1.463289
Badenhoop, J. K., Weinhold, F. (1997) Natural bond orbital analysis of steric interactions. The Journal of Chemical Physics, 107 (14). 5406-5421 doi:10.1063/1.474248
Reed, Alan E., Weinhold, Frank (1983) Natural bond orbital analysis of nearā€Hartreeā€“Fock water dimer. The Journal of Chemical Physics, 78 (6) 4066-4073 doi:10.1063/1.445134
Carpenter, J. E., Weinhold, F. (1988) Torsion-vibration interactions in hydrogen peroxide. 2. Natural bond orbital analysis. The Journal of Physical Chemistry, 92 (15). 4306-4313 doi:10.1021/j100326a013
Corcoran, C. T., Weinhold, F. (1980) Antisymmetrization effects in bondā€orbital models of internal rotation barriers. The Journal of Chemical Physics, 72 (4) 2866-2868 doi:10.1063/1.439385
Glendening, Eric D., Weinhold, Frank (2018) Efficient evaluation of poly-electron populations in natural bond orbital analysis. Chemical Physics Letters, 711. 23-26 doi:10.1016/j.cplett.2018.09.013
Weinhold, Frank (2012) Natural bond critical point analysis: Quantitative relationships between natural bond orbital-based and QTAIM-based topological descriptors of chemical bonding. Journal of Computational Chemistry, 33 (30). 2440-2449 doi:10.1002/jcc.23057
Reed, Alan E., Weinhold, Frank, Curtiss, Larry A., Pochatko, David J. (1986) Natural bond orbital analysis of molecular interactions: Theoretical studies of binary complexes of HF, H2O, NH3, N2, O2, F2, CO, and CO2 with HF, H2O, and NH3. The Journal of Chemical Physics, 84 (10). 5687-5705 doi:10.1063/1.449928
Bohmann, Jonathan A., Weinhold, Frank, Farrar, Thomas C. (1997) Natural chemical shielding analysis of nuclear magnetic resonance shielding tensors from gauge-including atomic orbital calculations. The Journal of Chemical Physics, 107 (4). 1173-1184 doi:10.1063/1.474464
Weinhold, Frank (2012) Natural bond orbital analysis: A critical overview of relationships to alternative bonding perspectives. Journal of Computational Chemistry, 33 (30). 2363-2379 doi:10.1002/jcc.23060
 
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 Ā© 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), 833ā€“844. doi:10.2138/am-2024-9486.
Privacy Policy - Terms & Conditions - Contact Us / DMCA issues - Report a bug/vulnerability Current server date and time: August 26, 2025 21:09:19
Go to top of page