From Ab Initio to Monte Carlo Methods
by
Kaoru Ohno, Keivan Esfarjani, Yoshiyuki Kawazoe
Language: English
Release Date: April 14, 2018
This textbook introduces modern techniques based on computer simulation to study materials science. It starts from first principles calculations enabling to calculate the physical and chemical properties by solving a many-body Schroedinger equation with Coulomb forces. For the exchange-correlation...