화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Studies of population analysis at the correlated level: Determination of three-center bond indices
Lain L, Torre A, Bochicchio R
Journal of Physical Chemistry A, 108(18), 4132, 2004
2 Bond orders and their relationships with cumulant and unpaired electron densities
Torre A, Lain L, Bochicchio R
Journal of Physical Chemistry A, 107(1), 127, 2003
3 On the definition of the spin-free cumulant of the second-order reduced density matrix
Lain L, Torre A, Bochicchio R
Journal of Chemical Physics, 117(11), 5497, 2002
4 On the nature of C-Li bonding in lithiated hydrocarbons and lithiocarbons
Ponec R, Roithova J, Girones X, Lain L, Torre A, Bochicchio R
Journal of Physical Chemistry A, 106(6), 1019, 2002
5 Pair population analysis within AIM theory
Bochicchio R, Ponec R, Lain L, Torre A
Journal of Physical Chemistry A, 104(40), 9130, 2000