Sign Learning Kink based Quantum Monte Carlo Applied to Multiple Large Systems H<sub>2</sub>O, N<sub>2</sub>, F<sub>2</sub>
A Sign Learning Kink (SiLK) based Quantum Monte Carlo (QMC) method is used to calculate the ground state energies for H<sub>2</sub>O, N<sub>2</sub> and F<sub>2</sub> molecules. This method has two stages. The first (learning stage) reduces the minus sign problem b...
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| Format: | Others |
| Language: | en |
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LSU
2015
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| Online Access: | http://etd.lsu.edu/docs/available/etd-07102015-163850/ |