Extension of the TraPPE Force Field for Battery Electrolyte Solvents.

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Title: Extension of the TraPPE Force Field for Battery Electrolyte Solvents.
Authors: Luo Z; State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, 127 West Youyi Road, Xi'an, Shaanxi 710072, People's Republic of China., Burrows SA; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom., Smoukov SK; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom., Fan X; State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, 127 West Youyi Road, Xi'an, Shaanxi 710072, People's Republic of China., Boek ES; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom.
Source: The journal of physical chemistry. B [J Phys Chem B] 2023 Mar 16; Vol. 127 (10), pp. 2224-2236. Date of Electronic Publication: 2023 Mar 02.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 101157530 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1520-5207 (Electronic) Linking ISSN: 15205207 NLM ISO Abbreviation: J Phys Chem B Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
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  Data: Extension of the TraPPE Force Field for Battery Electrolyte Solvents.
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  Data: <searchLink fieldCode="AU" term="%22Luo+Z%22">Luo Z</searchLink>; State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, 127 West Youyi Road, Xi'an, Shaanxi 710072, People's Republic of China.<br /><searchLink fieldCode="AU" term="%22Burrows+SA%22">Burrows SA</searchLink>; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Smoukov+SK%22">Smoukov SK</searchLink>; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Fan+X%22">Fan X</searchLink>; State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, 127 West Youyi Road, Xi'an, Shaanxi 710072, People's Republic of China.<br /><searchLink fieldCode="AU" term="%22Boek+ES%22">Boek ES</searchLink>; Chemical Engineering and Renewable Energy, School of Engineering and Materials Science, Queen Mary University of London, Mile End Road, London E1 4NS, United Kingdom.
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  Data: <searchLink fieldCode="JN" term="%22101157530%22">The journal of physical chemistry. B</searchLink> [J Phys Chem B] 2023 Mar 16; Vol. 127 (10), pp. 2224-2236. <i>Date of Electronic Publication: </i>2023 Mar 02.
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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>101157530 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1520-5207 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2215205207%22">15205207 </searchLink><i>NLM ISO Abbreviation: </i>J Phys Chem B <i>Subsets: </i>MEDLINE; PubMed not MEDLINE
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      – Type: doi
        Value: 10.1021/acs.jpcb.2c06993
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      – Code: eng
        Text: English
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      – TitleFull: Extension of the TraPPE Force Field for Battery Electrolyte Solvents.
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            NameFull: Luo Z
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            NameFull: Burrows SA
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            NameFull: Fan X
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            – D: 16
              M: 03
              Text: 2023 Mar 16
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              Value: 127
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              Value: 10
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