scholarly journals Applicability of resonating valence bond wave function with quantum Monte Carlo method for modeling high pressure liquid hydrogen

2013 ◽  
Vol 62 (15) ◽  
pp. 156101
Author(s):  
Li Ming-Rui ◽  
Zhou Gang ◽  
Chu Zhe ◽  
Dai Xiang-Hui ◽  
Wu Hai-Jun ◽  
...  
Keyword(s):  
High Pressure ◽  
Monte Carlo ◽  
Wave Function ◽  
Monte Carlo Method ◽  
Quantum Monte Carlo ◽  
Valence Bond ◽  
Liquid Hydrogen ◽  
Resonating Valence Bond ◽  
Quantum Monte Carlo Method

THE DIFFUSION QUANTUM MONTE CARLO METHOD: DESIGNING TRIAL WAVE FUNCTIONS FOR NiO

2003 ◽  
Vol 17 (28) ◽  
pp. 5425-5434 ◽  
Author(s):  
R. J. NEEDS ◽  
M. D. TOWLER
Keyword(s):  
Monte Carlo ◽  
Wave Function ◽  
Monte Carlo Method ◽  
Transition Metal ◽  
Quantum Monte Carlo ◽  
Monte Carlo Study ◽  
Trial Wave Function ◽  
Wave Functions ◽  
Quantum Monte Carlo Method

A brief overview of the diffusion quantum Monte Carlo method is given. The importance of the trial wave function is emphasised and we discuss how to design satisfactory forms for transition metal monoxides. Some results of a diffusion quantum Monte Carlo study of NiO are reported.

Released-phase quantum Monte Carlo method

1997 ◽  
Vol 55 (5) ◽  
pp. 6202-6210 ◽  
Author(s):  
Matthew D. Jones ◽  
Gerardo Ortiz ◽  
David M. Ceperley
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Quantum Monte Carlo ◽  
Quantum Monte Carlo Method
Sign in / Sign up

Export Citation Format

Share Document