Relatives of cyanomethylene: replacement of the divalent carbon by B − , N + , Al − , Si, P + , Ga − , Ge, and As +
Abstract
The lowest lying singlet and triplet states of nine relatives of cyanomethylene are studied with highly rigorous ab initio methods, and periodic trends in their electronic structures are analyzed.
- Authors:
-
- Center for Computational Quantum Chemistry, University of Georgia, Athens, USA
- Publication Date:
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1575951
- Grant/Contract Number:
- SC0018412
- Resource Type:
- Publisher's Accepted Manuscript
- Journal Name:
- Physical Chemistry Chemical Physics. PCCP (Print)
- Additional Journal Information:
- Journal Name: Physical Chemistry Chemical Physics. PCCP (Print) Journal Volume: 21 Journal Issue: 48; Journal ID: ISSN 1463-9076
- Publisher:
- Royal Society of Chemistry (RSC)
- Country of Publication:
- United Kingdom
- Language:
- English
Citation Formats
Abbott, Boyi Z., Hoobler, Preston R., and Schaefer, Henry F. Relatives of cyanomethylene: replacement of the divalent carbon by B − , N + , Al − , Si, P + , Ga − , Ge, and As +. United Kingdom: N. p., 2019.
Web. doi:10.1039/C9CP05777C.
Abbott, Boyi Z., Hoobler, Preston R., & Schaefer, Henry F. Relatives of cyanomethylene: replacement of the divalent carbon by B − , N + , Al − , Si, P + , Ga − , Ge, and As +. United Kingdom. doi:10.1039/C9CP05777C.
Abbott, Boyi Z., Hoobler, Preston R., and Schaefer, Henry F. Wed .
"Relatives of cyanomethylene: replacement of the divalent carbon by B − , N + , Al − , Si, P + , Ga − , Ge, and As +". United Kingdom. doi:10.1039/C9CP05777C.
@article{osti_1575951,
title = {Relatives of cyanomethylene: replacement of the divalent carbon by B − , N + , Al − , Si, P + , Ga − , Ge, and As +},
author = {Abbott, Boyi Z. and Hoobler, Preston R. and Schaefer, Henry F.},
abstractNote = {The lowest lying singlet and triplet states of nine relatives of cyanomethylene are studied with highly rigorous ab initio methods, and periodic trends in their electronic structures are analyzed.},
doi = {10.1039/C9CP05777C},
journal = {Physical Chemistry Chemical Physics. PCCP (Print)},
number = 48,
volume = 21,
place = {United Kingdom},
year = {2019},
month = {12}
}
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DOI: 10.1039/C9CP05777C
DOI: 10.1039/C9CP05777C
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