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Machine-Learned Potentials by Active Learning from Organic Crystal Structure Prediction Landscapes.

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Title: Machine-Learned Potentials by Active Learning from Organic Crystal Structure Prediction Landscapes.
Authors: Butler PWV; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K., Hafizi R; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K., Day GM; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.
Source: The journal of physical chemistry. A [J Phys Chem A] 2024 Feb 08; Vol. 128 (5), pp. 945-957. Date of Electronic Publication: 2024 Jan 26.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 9890903 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1520-5215 (Electronic) Linking ISSN: 10895639 NLM ISO Abbreviation: J Phys Chem A Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Butler+PWV%22">Butler PWV</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.<br /><searchLink fieldCode="AU" term="%22Hafizi+R%22">Hafizi R</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.<br /><searchLink fieldCode="AU" term="%22Day+GM%22">Day GM</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22American+Chemical+Society%22">American Chemical Society </searchLink><i>Country of Publication: </i>United States <i>NLM ID: </i>9890903 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1520-5215 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2210895639%22">10895639 </searchLink><i>NLM ISO Abbreviation: </i>J Phys Chem A <i>Subsets: </i>MEDLINE; PubMed not MEDLINE
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        Value: 10.1021/acs.jpca.3c07129
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      – TitleFull: Machine-Learned Potentials by Active Learning from Organic Crystal Structure Prediction Landscapes.
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              Text: 2024 Feb 08
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              Y: 2024
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