Articles with "properties efficient" as a keyword



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Accurate water properties from an efficient ab-initio method.

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Published in 2020 at "Journal of chemical theory and computation"

DOI: 10.1021/acs.jctc.9b01018

Abstract: Accurate prediction of the water properties from a low-cost ab-initio method is still a foremost problem for chemists and physicists. Though density functional approaches starting from semilocal to hybrid exchange-correlation functionals are tested, those are… read more here.

Keywords: properties efficient; accurate water; water; method ... See more keywords
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The Modified-Half-Normal distribution: Properties and an efficient sampling scheme

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Published in 2021 at "Communications in Statistics - Theory and Methods"

DOI: 10.1080/03610926.2021.1934700

Abstract: We introduce a new family of probability distributions that we call the Modified-Half-Normal distributions. It is supported on the positive part of the real line with its probability density propor... read more here.

Keywords: properties efficient; modified half; distribution properties; normal distribution ... See more keywords