Journal of Chemical Theory and Computation

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Journal description

Title Titel
Journal of Chemical Theory and Computation
 
e-ISSN
1549-9626
 
ISSN
1549-9618
 
Publisher Herausgeber
AMER CHEMICAL SOC
 

Publications Publikationen

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Author:  Botti, Silvana

Results 1-2 of 2 (Search time: 0.001 seconds).

PreviewAuthor(s)TitleTypeIssue Date
1Borlido, Pedro ; Aull, Thorsten ; Huran, Ahmad W. ; Tran, Fabien ; Marques, Miguel A. L. ; Botti, Silvana Large-Scale Benchmark of Exchange-Correlation Functionals for the Determination of Electronic Band Gaps of SolidsArtikel Article 2019
2Borlido, Pedro ; Doumont, Jan ; Tran, Fabien ; Marques, Miguel A. L. ; Botti, Silvana Validation of Pseudopotential Calculations for the Electronic Band Gap of SolidsArtikel Article 2020