RingPolymerMolecularDynamics相关论文
Ring Polymer Molecular Dynamics of the C(1D)+H2 Reaction on the Most Recent Potential Energy Surface
Ring polymer molecular dynam-ics (RPMD) calculations for the C(1D)+H2 reaction are performed on the Zhang-Ma-Bian ab ini......
Construction of Potential Energy Surface for ClH2O System and Its Application in Ring Polymer Molecu
A new and more accurate full-dimensional global permutation invariant polynomial-neural network(PIP-NN)potential energy ......