Vote for your favorite mineral in #MinCup25! - Taenite vs. Nontronite
It's a mineral found mostly in the farthest reaches of space vs one so common an exhaustive list of localities is nigh impossible as alloy #taenite faces off against clay #nontronite.
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

Sun, Guangyu, Kertesz, Miklos (2001) Identification for IPR Isomers of Fullerene C82by Theoretical13C NMR Spectra Calculated by Density Functional Theory. The Journal of Physical Chemistry A, 105 (22). 5468-5472 doi:10.1021/jp004544z

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleIdentification for IPR Isomers of Fullerene C82by Theoretical13C NMR Spectra Calculated by Density Functional Theory
JournalThe Journal of Physical Chemistry A
AuthorsSun, GuangyuAuthor
Kertesz, MiklosAuthor
Year2001 (June)Volume105
Issue22
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp004544zSearch in ResearchGate
Generate Citation Formats
Mindat Ref. ID3942015Long-form Identifiermindat:1:5:3942015:6
GUID0
Full ReferenceSun, Guangyu, Kertesz, Miklos (2001) Identification for IPR Isomers of Fullerene C82by Theoretical13C NMR Spectra Calculated by Density Functional Theory. The Journal of Physical Chemistry A, 105 (22). 5468-5472 doi:10.1021/jp004544z
Plain TextSun, Guangyu, Kertesz, Miklos (2001) Identification for IPR Isomers of Fullerene C82by Theoretical13C NMR Spectra Calculated by Density Functional Theory. The Journal of Physical Chemistry A, 105 (22). 5468-5472 doi:10.1021/jp004544z
In(2001, June) The Journal of Physical Chemistry A Vol. 105 (22) American Chemical Society (ACS)

See Also

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

Sun, Guangyu, Kertesz, Miklos (2000) Theoretical13C NMR Spectra of IPR Isomers of Fullerenes C60, C70, C72, C74, C76, and C78Studied by Density Functional Theory. The Journal of Physical Chemistry A, 104 (31). 7398-7403 doi:10.1021/jp001272r
Sun, Guangyu, Kertesz, Miklos (2001) Isomer Identification for Fullerene C84by13C NMR Spectrum:  A Density-Functional Theory Study. The Journal of Physical Chemistry A, 105 (21). 5212-5220 doi:10.1021/jp0108418
Sun, Guangyu, Kertesz, Miklos (2000) Theoretical 13C NMR spectra of IPR isomers of fullerene C80: a density functional theory study. Chemical Physics Letters, 328. 387-395 doi:10.1016/s0009-2614(00)00969-6
Sun, Guangyu, Kertesz, Miklos (2002) 13C NMR spectra for IPR isomers of fullerene C86. Chemical Physics, 276. 107-114 doi:10.1016/s0301-0104(01)00576-6
Sun, Guangyu, Kertesz, Miklos (2002) Vibrational Raman Spectra of C70and C706-Studied by Density Functional Theory. The Journal of Physical Chemistry A, 106 (26). 6381-6386 doi:10.1021/jp020222e
Sun, Guangyu, Kertesz, Miklos (2000) Theoretical evidence for the major isomers of fullerene C84 based on 13C NMR chemical shifts. New Journal of Chemistry, 24. 741-743 doi:10.1039/b004944l
Sun, Guangyu, Kürti, Jenő, Kertesz, Miklos, Baughman, Ray H. (2002) Dimensional changes as a function of charge injection for trans-polyacetylene: A density functional theory study. The Journal of Chemical Physics, 117 (16). 7691-7697 doi:10.1063/1.1509052
Sun, Guangyu, Kertesz, Miklos, Kürti, Jenõ, Baughman, Ray H. (2003) Dimensional change as a function of charge injection in graphite intercalation compounds:  A density functional theory study. Physical Review B, 68 (12) doi:10.1103/physrevb.68.125411
Nagashima, Naoko, Kudoh, Satoshi, Takayanagi, Masao, Nakata, Munetaka (2001) UV-Induced Photoisomerization of Acetylacetone and Identification of Less-Stable Isomers by Low-Temperature Matrix-Isolation Infrared Spectroscopy and Density Functional Theory Calculation. The Journal of Physical Chemistry A, 105 (48). 10832-10838 doi:10.1021/jp012557m
Sun, Guangyu (2003) Assigning the major isomers of fullerene C88 by theoretical 13C NMR spectra. Chemical Physics Letters, 367. 26-33 doi:10.1016/s0009-2614(02)01664-0
Tozzini, Valentina, Buda, Francesco, Fasolino, Annalisa (2001) Fullerene-like III−V Clusters:  A Density Functional Theory Prediction. The Journal of Physical Chemistry B, 105 (50). 12477-12480 doi:10.1021/jp0134087
 
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 15, 2025 20:53:35
Go to top of page