Efficient Estimation of Formation Enthalpies for Closed-Shell Organic Compounds with Local Coupled-Cluster Methods

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Efficient Estimation of Formation Enthalpies for Closed-Shell Organic Compounds with Local Coupled-Cluster Methods is …
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scholarly articleQ13442814

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P356DOI10.1021/ACS.JCTC.8B00593
P698PubMed publication ID30234978

P50authorEugene PaulechkaQ88086429
P2093author name stringAndrei Kazakov
P2860cites workExchange–Correlation Functional with Good Accuracy for Both Structural and Energetic Properties while Depending Only on the Density and Its GradientQ57401988
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P433issue11
P407language of work or nameEnglishQ1860
P304page(s)5920-5932
P577publication date2018-10-05
P1433published inJournal of Chemical Theory and ComputationQ1768377
P1476titleEfficient Estimation of Formation Enthalpies for Closed-Shell Organic Compounds with Local Coupled-Cluster Methods
P478volume14

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Q90283038Validation of thermophysical data for scientific and engineering applicationscites workP2860

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