화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Matrix Isolation FTIR Spectroscopic and Theoretical Study of 3,3-Dichloro-1,1,1-Trifluoropropane (HCFC-243)
Lucena JR, Sharma A, Reva ID, Araujo RMCU, Ventura E, do Monte SA, Braga CF, Ramos MN, Fausto R
Journal of Physical Chemistry A, 112(46), 11641, 2008
2 An energetic quantification of inter-intramolecular interactions in the C2H2-2HF and C2H4O-2HF trimolecular hydrogen bonded complexes: DFT calculations and AIM topological parameters
Oliveira BG, Araujo RCMU, Carvalho AB, Ramos MN
Chemical Physics Letters, 433(4-6), 390, 2007
3 The hydrogen bond strength: New proposals to evaluate the intermolecular interaction using DFT calculations and the AIM theory
Oliveira BG, Pereira FS, de Araujo RCMU, Ramos MN
Chemical Physics Letters, 427(1-3), 181, 2006
4 Green's function matrix elements and charge transfer on the CnNH center dot center dot center dot CnNH and CnNH center dot center dot center dot NCnH (n=1 and 3) hydrogen bonded complexes
Parnaiba-daSilva AJ, da Silva JBP, da Gama AAS, Ramos MN
Chemical Physics Letters, 362(1-2), 159, 2002
5 Transferability of the cis- and trans-dichloroethylene atomic polar tensors
daSilva JBP, Ramos MN, Suto E, Bruns RE
Journal of Physical Chemistry A, 101(35), 6293, 1997