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Title: Quantum Monte Carlo benchmark of exchange-correlation functionals for bulk water

Journal Article · · Journal of Chemical Theory and Computation
DOI:https://doi.org/10.1021/ct500129p· OSTI ID:1226954
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Research Organization:
Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Oak Ridge Leadership Computing Facility (OLCF); Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC)
DOE Contract Number:
AC52-07NA27344
OSTI ID:
1226954
Report Number(s):
LLNL-JRNL-648576
Journal Information:
Journal of Chemical Theory and Computation, Vol. 10, Issue 6; ISSN 1549-9618
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English

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