Title of article :
A variational path integral molecular dynamics study of a solid helium-4 Original Research Article
Author/Authors :
Shinichi Miura، نويسنده ,
Issue Information :
ماهنامه با شماره پیاپی سال 2011
Abstract :
In the present study, a variational path integral molecular dynamics method developed by the author [Chem. Phys. Lett. 482 (2009) 165] is applied to a solid helium-4 in the ground state. The method is a molecular dynamics algorithm for a variational path integral method which can be used to generate the exact ground state numerically. The solid state is shown to successfully be realized by the method, although a poor trial wavefunction that cannot describe the solid state is used.
Keywords :
Quantum Monte Carlo , Variational path integral , molecular dynamics , Solid helium-4
Journal title :
Computer Physics Communications
Journal title :
Computer Physics Communications