메뉴 건너뛰기




Volumn 125, Issue 12, 2006, Pages

Intermolecular interactions of nitrobenzene-benzene complex and nitrobenzene dimer: Significant stabilization of slipped-parallel orientation by dispersion interaction

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE; DISPERSIONS; ELECTRON ENERGY LEVELS; MOLECULAR DYNAMICS;

EID: 33749267227     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2354495     Document Type: Article
Times cited : (52)

References (69)
  • 49
    • 33749258576 scopus 로고    scopus 로고
    • CCSD(T)(limit) by the ARS-E and ARS model, evaluation of the effects of geometry optimization on the calculated interaction energy, evaluation of the basis set effects on the calculated electrostatic energy, and tables showing the basis set dependence of the HF and MP2 interaction energies, effects of electron correlation beyond MP2, the CCSD(T) level interaction energy potentials of 17 orientation complexes obtained by ARS model, and the estimated HF and MP2 interaction energies using the methods of Helgaker et al. and Feller. This document can be reached via a direct link in the online article's HTML reference section or via the EPAPS homepage (http://www.aip.org/pubservs/epaps.html).
  • 66
    • 33749239452 scopus 로고    scopus 로고
    • corr, it includes some other terms such as the effects of intramolecular electron correlation on the electrostatic energy
    • corr, it includes some other terms such as the effects of intramolecular electron correlation on the electrostatic energy.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.