共 50 条
- [21] Molecular Density Functional Theory of Water JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2013, 4 (04): : 619 - 624
- [23] Density functional theory of molecular fragments ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
- [25] Density functional theory of solvation and its relation to implicit solvent models JOURNAL OF PHYSICAL CHEMISTRY B, 2005, 109 (14): : 6754 - 6763
- [28] Density functional theory studies of alkyl adsorption and solvation on transition metals ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244
- [29] Electrode potential from density functional theory calculations combined with implicit solvation theory PHYSICAL REVIEW MATERIALS, 2018, 2 (09):
- [30] Electrostatic solvation free energies of charged hard spheres using molecular dynamics with density functional theory interactions JOURNAL OF CHEMICAL PHYSICS, 2017, 147 (16):