24569

Slab-Geometry Molecular Dynamics Simulations: Development and Application to Calculation of Activity Coefficients, Interfacial Electrochemistry, and Ion Channel Transport

Brigham young University

نامعلوم

Chemical Engineering

0

2002

slab geometry , Molecular dynamics , intermolecular coulombic interactions , Corrected 3-D Ewald method , long-range force calculation , charged-sheet method , activity , interfacial chemistry

01

انگليسي