Diffusion Monte Carlo simulations of the dipole-bound state of the water dimer anion
It is shown how the diffusion quantum Monte Carlo method for solving the Schrödinger equation can be adapted to calculate the lowest energy state of a dipole-bound cluster anion. Specifically, the method can be used to calculate the rotationally adiabatic potential curve that arises due to the inter...
| Main Authors: | , |
|---|---|
| Format: | Journal article |
| Language: | English |
| Published: |
1999
|