Modelling infrared spectra of the O-H stretches in liquid H2O based on a deep learning potential, the importance of nuclear quantum effects.
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| Title: | Modelling infrared spectra of the O-H stretches in liquid H |
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| Authors: | Li, Dongyao1 (AUTHOR), Zhao, Dan1 (AUTHOR), Huang, Yao1 (AUTHOR), Shen, Hujun1,2 (AUTHOR) hujun.shen@hotmail.com, Deng, Mingsen1 (AUTHOR) |
| Source: | Molecular Simulation. May/Jun2024, Vol. 50 Issue 7-9, p539-546. 8p. |
| Database: | Academic Search Ultimate |
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| FullText | Links: – Type: pdflink Text: Availability: 1 |
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| Header | DbId: asn DbLabel: Academic Search Ultimate An: 176897168 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Modelling infrared spectra of the O-H stretches in liquid H<subscript>2</subscript>O based on a deep learning potential, the importance of nuclear quantum effects. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AR" term="%22Li%2C+Dongyao%22">Li, Dongyao</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Zhao%2C+Dan%22">Zhao, Dan</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Huang%2C+Yao%22">Huang, Yao</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Shen%2C+Hujun%22">Shen, Hujun</searchLink><relatesTo>1,2</relatesTo> (AUTHOR)<i> hujun.shen@hotmail.com</i><br /><searchLink fieldCode="AR" term="%22Deng%2C+Mingsen%22">Deng, Mingsen</searchLink><relatesTo>1</relatesTo> (AUTHOR) – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22Molecular+Simulation%22">Molecular Simulation</searchLink>. May/Jun2024, Vol. 50 Issue 7-9, p539-546. 8p. |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=asn&AN=176897168 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1080/08927022.2024.2328724 Languages: – Code: eng Text: English PhysicalDescription: Pagination: PageCount: 8 StartPage: 539 Titles: – TitleFull: Modelling infrared spectra of the O-H stretches in liquid H2O based on a deep learning potential, the importance of nuclear quantum effects. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Li, Dongyao – PersonEntity: Name: NameFull: Zhao, Dan – PersonEntity: Name: NameFull: Huang, Yao – PersonEntity: Name: NameFull: Shen, Hujun – PersonEntity: Name: NameFull: Deng, Mingsen IsPartOfRelationships: – BibEntity: Dates: – D: 01 M: 05 Text: May/Jun2024 Type: published Y: 2024 Identifiers: – Type: issn-print Value: 08927022 Numbering: – Type: volume Value: 50 – Type: issue Value: 7-9 Titles: – TitleFull: Molecular Simulation Type: main |
| ResultId | 1 |