화학공학소재연구정보센터
검색결과 : 4건
No. Article
1 Molecular hardness, polarizability and valency variation of formamide and thioformamide on internal rotation: A density functional study
Ghanty TK, Ghosh SK
Journal of Physical Chemistry A, 104(13), 2975, 2000
2 Chemical reactivity and excited-state density functional theory
Chattaraj PK, Poddar A
Journal of Physical Chemistry A, 103(9), 1274, 1999
3 Reactivity index scale for interaction of heteroatomic molecules with zeolite framework
Chatterjee A, Iwasaki T, Ebina T
Journal of Physical Chemistry A, 103(15), 2489, 1999
4 A density functional treatment of chemical reactivity and the associated electronic structure principles in the excited electronic states
Chattaraj PK, Poddar A
Journal of Physical Chemistry A, 102(48), 9944, 1998