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

Shi, Deheng, Xing, Wei, Liu, Hui, Sun, Jinfeng, Zhu, Zunlue, Liu, Yufang (2012) Electronic spectrum of 17 electronic states of BN molecule: A theoretical study. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 93. 367-378 doi:10.1016/j.saa.2012.03.029

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleElectronic spectrum of 17 electronic states of BN molecule: A theoretical study
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsShi, DehengAuthor
Xing, WeiAuthor
Liu, HuiAuthor
Sun, JinfengAuthor
Zhu, ZunlueAuthor
Liu, YufangAuthor
Year2012 (July)Volume93
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2012.03.029Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID16392711Long-form Identifiermindat:1:5:16392711:8
GUID0
Full ReferenceShi, Deheng, Xing, Wei, Liu, Hui, Sun, Jinfeng, Zhu, Zunlue, Liu, Yufang (2012) Electronic spectrum of 17 electronic states of BN molecule: A theoretical study. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 93. 367-378 doi:10.1016/j.saa.2012.03.029
Plain TextShi, Deheng, Xing, Wei, Liu, Hui, Sun, Jinfeng, Zhu, Zunlue, Liu, Yufang (2012) Electronic spectrum of 17 electronic states of BN molecule: A theoretical study. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 93. 367-378 doi:10.1016/j.saa.2012.03.029
In(2012) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 93. Elsevier BV

See Also

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

Shi, Deheng, Xing, Wei, Liu, Hui, Sun, Jinfeng, Zhu, Zunlue (2012) MRCI study on electronic spectrum of 13 electronic states of SiP molecule. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 97. 536-545 doi:10.1016/j.saa.2012.06.031
Xing, Wei, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2017) MRCI study of the spectroscopic parameters and transition properties of the 36 low-lying electronic states of the B 2 molecule. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 185. 349-364 doi:10.1016/j.saa.2017.05.074
Shi, Deheng, Li, Wentao, Xing, Wei, Sun, Jinfeng, Zhu, Zunlue, Liu, Yufang (2012) MRCI study on electronic spectrum of several low-lying electronic states of the SiO+ cation. Computational and Theoretical Chemistry, 980. 73-84 doi:10.1016/j.comptc.2011.11.016
Liu, Hui, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2013) Theoretical study on ten Λ–S states of anion: Potential energy curves, spectroscopy and spin–orbit couplings. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 108. 295-306 doi:10.1016/j.saa.2013.01.095
Liu, Hui, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2013) Accurate ab initio study on the A2Π, 14Σ+, 14Π, 24Π and 16Σ+ electronic states of AlO radical including spin–orbit coupling. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 101. 400-409 doi:10.1016/j.saa.2012.09.087
Shi, Deheng, Li, Wentao, Sun, Jinfeng, Zhu, Zunlue (2012) MRCI study on the spectroscopic parameters and molecular constants of the X1Σ+, a3Σ+, A1Π and C1Σ− electronic states of the SiO molecule. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 87. 96-105 doi:10.1016/j.saa.2011.11.017
Liu, Hui, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue, Shulin, Zhang (2014) Accurate calculations on the 22 electronic states and 54 spin-orbit states of the O2 molecule: Potential energy curves, spectroscopic parameters and spin-orbit coupling. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 124. 216-229 doi:10.1016/j.saa.2014.01.003
Liu, Hui, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2017) Multireference configuration interaction study of the 27 low-lying states of the PF+ cation. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 181. 226-238 doi:10.1016/j.saa.2017.03.050
Liu, Hui, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2017) Accurate spectroscopic calculations of the 22 Λ-S states and 60 Ω states of the PS + cation. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 178. 55-65 doi:10.1016/j.saa.2017.01.045
Wang, Xinxin, Shi, Deheng, Sun, Jinfeng, Zhu, Zunlue (2016) Accurate spectroscopic calculations of 21 electronic states of ClO radical including transition properties. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 165. 90-98 doi:10.1016/j.saa.2016.04.007
Shi, Deheng, Xing, Wei, Zhang, Xiaoniu, Sun, Jinfeng, Zhu, Zunlue, Liu, Yufang (2011) Spectroscopic and molecular properties of X1Σ+, a3Σ+, b3Π, d3Δ, C1Σ−, e3Σ−, D1Δ and A1Π electronic states of SiS molecule. Computational and Theoretical Chemistry, 969 (1). 17-26 doi:10.1016/j.comptc.2011.05.007
 
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: August 30, 2025 07:20:42
Go to top of page