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. |
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| 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 |
| ISSN: | 1520-5215 |
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| DOI: | 10.1021/acs.jpca.3c07129 |
