Structures and energetics of new nitrogen and silicon molecules: an ab initio study of 'SI IND.2''N IND.2' (1996)
- Autor:
- Autor USP: ORNELLAS, FERNANDO REI - IQ
- Unidade: IQ
- Assunto: FÍSICO-QUÍMICA
- Language: Inglês
- Imprenta:
- Source:
- Título: Book of Abstracts
- Conference titles: International Chemical Congress of Pacific Basin Societies
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ABNT
ORNELLAS, Fernando Rei. Structures and energetics of new nitrogen and silicon molecules: an ab initio study of 'SI IND.2''N IND.2'. 1996, Anais.. Honolulu: Instituto de Química, Universidade de São Paulo, 1996. . Acesso em: 22 jan. 2026. -
APA
Ornellas, F. R. (1996). Structures and energetics of new nitrogen and silicon molecules: an ab initio study of 'SI IND.2''N IND.2'. In Book of Abstracts. Honolulu: Instituto de Química, Universidade de São Paulo. -
NLM
Ornellas FR. Structures and energetics of new nitrogen and silicon molecules: an ab initio study of 'SI IND.2''N IND.2'. Book of Abstracts. 1996 ;[citado 2026 jan. 22 ] -
Vancouver
Ornellas FR. Structures and energetics of new nitrogen and silicon molecules: an ab initio study of 'SI IND.2''N IND.2'. Book of Abstracts. 1996 ;[citado 2026 jan. 22 ] - CASSCF and MRMP2 investigation of the interaction of arsenic adatoms with carbon dimers on the diamond (100)-2 x 1 surface
- A theoretical study of 'SN''F POT. 2+', 'SN''CL POT. 2+', and 'SN'O POT. 2+' and their experimental search
- Theoretical spectroscopic study of a new diatomic species: beb
- Theoretical spectroscopic characterization of the `B POT. 2´`sigma POT. +´ state of SiP and of the `X POT. 2´II-`B POT. 2´`sigma POT. +´ and `A POT. 2´`sigma POT. +´-`B POT. 2´`sigma POT. +´ transitions
- Mechanism and kinetics of the reaction between HS and Cl radicals
- Ab inition study of the transition moments , transition probabilities, and radiative lifetimes of the quartet states of the ben molecule
- Ab initio studies of silicon and nitrigen clusters: cyclic or linear 'SI IND.2'n
- Dual-level direct dynamics calculations of kinetic isotope effects for the 'CH IND. 4'+F 'arrow' 'CH IND.3'+ HF abstraction reaction
- Estudo da reação entre radical metila e flúor atômico no estado fundamental ('ANTPOT. 2 P')
- Winterschool: computational chemistry and physics on the nanoscale
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