Can contemporary density functional theory yield accurate thermodynamics for hydrogen bonding
Can contemporary density functional theory yield accurate thermodynamics for hydrogen bonding
复制标题
现代密度泛函理论能否产生准确的氢键热力学
DOI:
10.1016/0009-2614(95)01178-x
复制
发表时间:
1995
影响因子:
2.8
通讯作者:
A. Rashin
中科院分区:
文献类型:
--
作者:
I. Topol;S. Burt;A. Rashin