scholarly journals Bulk and surface energetics of crystalline lithium hydride: Benchmarks from quantum Monte Carlo and quantum chemistry

2010 ◽  
Vol 82 (16) ◽  
Author(s):  
S. J. Binnie ◽  
S. J. Nolan ◽  
N. D. Drummond ◽  
D. Alfè ◽  
N. L. Allan ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Quantum Chemistry ◽  
Quantum Monte Carlo ◽  
Lithium Hydride ◽  
Surface Energetics

scholarly journals Quantum Monte Carlo tunneling from quantum chemistry to quantum annealing

2017 ◽  
Vol 96 (13) ◽  
Author(s):  
Guglielmo Mazzola ◽  
Vadim N. Smelyanskiy ◽  
Matthias Troyer
Keyword(s):  
Monte Carlo ◽  
Quantum Chemistry ◽  
Quantum Monte Carlo ◽  
Quantum Annealing

Is quantum Monte Carlo competitive? Lithium hydride test case

1987 ◽  
Vol 91 (7) ◽  
pp. 2004-2005 ◽  
Author(s):  
R. N. Barnett ◽  
P. J. Reynolds ◽  
W. A. Lester
Keyword(s):  
Monte Carlo ◽  
Quantum Monte Carlo ◽  
Lithium Hydride ◽  
Test Case

scholarly journals Quantum chemistry by quantum monte carlo: Beyond ground-state energy calculations

1986 ◽  
Vol 29 (4) ◽  
pp. 589-596 ◽  
Author(s):  
P. J. Reynolds ◽  
R. N. Barnett ◽  
B. L. Hammond ◽  
R. M. Grimes ◽  
W. A. Lester
Keyword(s):  
Monte Carlo ◽  
Quantum Chemistry ◽  
Ground State Energy ◽  
Ground State ◽  
Quantum Monte Carlo ◽  
State Energy ◽  
Energy Calculations

scholarly journals A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface

2017 ◽  
Vol 146 (20) ◽  
pp. 204108 ◽  
Author(s):  
Theodoros Tsatsoulis ◽  
Felix Hummel ◽  
Denis Usvyat ◽  
Martin Schütz ◽  
George H. Booth ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Quantum Chemistry ◽  
Quantum Monte Carlo ◽  
Monte Carlo Techniques ◽  
Adsorption Of Water
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