Statistical learning goes beyond the d-band model providing the thermochemistry of adsorbates on transition metals

Dataset of the article: https://www.nature.com/articles/s41467-019-12709-1

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This dataset derived results are published in:

Manuscript title: Statistical learning predicts the thermochemistry of adsorbed species on transition metals beyond the d-band model

Journal: Nat. Commun.

DOI: 10.1038/s41467-019-12709-1

PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegsa-AgAu-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--126.08524327; eV
thumbnail.jpegsa-AgCd-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--123.78857640; eV
thumbnail.jpegsa-AgCo-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--127.96298435; eV
thumbnail.jpegsa-AgCu-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--125.85286885; eV
thumbnail.jpegsa-AgFe-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--128.16850363; eV
thumbnail.jpegsa-AgIr-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--129.74410496; eV
thumbnail.jpegsa-AgNi-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--127.08435025; eV
thumbnail.jpegsa-AgOs-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--130.41531441; eV
thumbnail.jpegsa-AgPd-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--127.86628519; eV
thumbnail.jpegsa-AgPt-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--128.54281494; eV
thumbnail.jpegsa-AgRe-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--130.89289156; eV
thumbnail.jpegsa-AgRh-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--128.85846519; eV
thumbnail.jpegsa-AgRu-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--129.31474954; eV
thumbnail.jpegsa-AgZn-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--123.90690372; eV
thumbnail.jpegsa-AuAg-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--150.31645384; eV
thumbnail.jpegsa-AuCd-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--149.00839253; eV
thumbnail.jpegsa-AuCo-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--153.32666162; eV
thumbnail.jpegsa-AuCu-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--150.95171569; eV
thumbnail.jpegsa-AuIr-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--154.57845412; eV
thumbnail.jpegsa-AuNi-0000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--152.12176911; eV
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