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Published in 2022 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.2c00934
Abstract: We report the development of a python-based auxiliary-field quantum Monte Carlo (AFQMC) program, ipie, with preliminary timing benchmarks and new AFQMC results on the isomerization of [Cu2O2]2+. We demonstrate how implementations for both central and…
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Keywords:
python based;
ipie;
based auxiliary;
auxiliary field ... See more keywords
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Published in 2021 at "Applied Sciences"
DOI: 10.3390/app11104509
Abstract: This paper addresses the problem of optimizing the voltage profile of radially-operated distribution systems by acting on the active and reactive powers provided by distributed energy resources (DERs). A novel voltage optimization procedure is proposed…
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Keywords:
voltage optimization;
voltage;
problem;
based auxiliary ... See more keywords