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Published in 2025 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.5c01138
Abstract: We introduce an efficient approach to implement neural network quantum states (NNQS) as trial wave functions in auxiliary-field quantum Monte Carlo (AFQMC). NNQS are a recently developed class of variational ansätze capable of flexibly representing…
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Keywords:
nnqs afqmc;
network quantum;
quantum states;
trial ... See more keywords