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Optical and excited state properties of Au30(S-Adm)18 and Au38S2(S-Adm)20 nanoclusters: Accuracy from TD-DFT and TDDFT + TB approaches.

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Title: Optical and excited state properties of Au30(S-Adm)18 and Au38S2(S-Adm)20 nanoclusters: Accuracy from TD-DFT and TDDFT + TB approaches.
Authors: Acharya, Dinesh1, Liang, Hao1, Muñoz-Castro, Alvaro2, Zhang, Chengkai1, Han, Baoliang1, Gupta, Rakesh Kumar1, Wang, Zhi1, Gao, Zhi-Yong3, Azam, Mohammad4, Sun, Di1 dsun@sdu.edu.cn
Source: Journal of Chemical Physics. 10/28/2025, Vol. 163 Issue 16, p1-11. 11p.
Database: Academic Search Ultimate
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An: 189040006
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PubType: Academic Journal
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  Data: Optical and excited state properties of Au<subscript>30</subscript>(S-Adm)<subscript>18</subscript> and Au<subscript>38</subscript>S<subscript>2</subscript>(S-Adm)<subscript>20</subscript> nanoclusters: Accuracy from TD-DFT and TDDFT + TB approaches.
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  Data: <searchLink fieldCode="AR" term="%22Acharya%2C+Dinesh%22">Acharya, Dinesh</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Liang%2C+Hao%22">Liang, Hao</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Muñoz-Castro%2C+Alvaro%22">Muñoz-Castro, Alvaro</searchLink><relatesTo>2</relatesTo><br /><searchLink fieldCode="AR" term="%22Zhang%2C+Chengkai%22">Zhang, Chengkai</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Han%2C+Baoliang%22">Han, Baoliang</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Gupta%2C+Rakesh+Kumar%22">Gupta, Rakesh Kumar</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Wang%2C+Zhi%22">Wang, Zhi</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AR" term="%22Gao%2C+Zhi-Yong%22">Gao, Zhi-Yong</searchLink><relatesTo>3</relatesTo><br /><searchLink fieldCode="AR" term="%22Azam%2C+Mohammad%22">Azam, Mohammad</searchLink><relatesTo>4</relatesTo><br /><searchLink fieldCode="AR" term="%22Sun%2C+Di%22">Sun, Di</searchLink><relatesTo>1</relatesTo><i> dsun@sdu.edu.cn</i>
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  Data: <searchLink fieldCode="JN" term="%22Journal+of+Chemical+Physics%22">Journal of Chemical Physics</searchLink>. 10/28/2025, Vol. 163 Issue 16, p1-11. 11p.
PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=asn&AN=189040006
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        Value: 10.1063/5.0292988
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      – TitleFull: Optical and excited state properties of Au30(S-Adm)18 and Au38S2(S-Adm)20 nanoclusters: Accuracy from TD-DFT and TDDFT + TB approaches.
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              Text: 10/28/2025
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