1
TITLE: Machine-Learning-Assisted Determination of the Global Zero-Temperature Phase Diagram of Materials  Full Text
AUTHORS: Schmidt, Jonathan; Hoffmann, Noah; Wang, Hai Chen; Borlido, Pedro; Carrico, Pedro J. M. A.; Cerqueira, Tiago F. T.; Botti, Silvana; Marques, Miguel A. L.;
PUBLISHED: 2023, SOURCE: ADVANCED MATERIALS
INDEXED IN: Scopus WOS
2
TITLE: Searching for ductile superconducting Heusler X(2)YZ compounds
AUTHORS: Hoffmann, Noah; Cerqueira, Tiago F. T.; Borlido, Pedro; Sanna, Antonio; Schmidt, Jonathan; Marques, Miguel A. L.;
PUBLISHED: 2023, SOURCE: NPJ COMPUTATIONAL MATERIALS, VOLUME: 9, ISSUE: 1
INDEXED IN: Scopus WOS
3
TITLE: A dataset of 175k stable and metastable materials calculated with the PBEsol and SCAN functionals
AUTHORS: Schmidt, J; Wang, HC; Cerqueira, TFT; Botti, S; Marques, MAL;
PUBLISHED: 2022, SOURCE: SCIENTIFIC DATA, VOLUME: 9, ISSUE: 1
INDEXED IN: Scopus WOS
4
TITLE: Computational screening of materials with extreme gap deformation potentials
AUTHORS: Borlido, Pedro; Schmidt, Jonathan; Wang, Hai Chen; Botti, Silvana; Marques, Miguel A. L.;
PUBLISHED: 2022, SOURCE: NPJ COMPUTATIONAL MATERIALS, VOLUME: 8, ISSUE: 1
INDEXED IN: Scopus WOS
5
TITLE: Superconductivity in antiperovskites
AUTHORS: Hoffmann, Noah; Cerqueira, Tiago F. T.; Schmidt, Jonathan; Marques, Miguel A. L.;
PUBLISHED: 2022, SOURCE: NPJ COMPUTATIONAL MATERIALS, VOLUME: 8, ISSUE: 1
INDEXED IN: Scopus WOS
6
TITLE: Special issue in honor of Eberhard KU Gross for his 65th birthday  Full Text
AUTHORS: Miguel A L Marques; Fernando Nogueira; Angel Rubio; Carsten A Ullrich;
PUBLISHED: 2018, SOURCE: EUROPEAN PHYSICAL JOURNAL B, VOLUME: 91, ISSUE: 11
INDEXED IN: Scopus WOS
7
TITLE: Materials Design On-the-Fly  Full Text
AUTHORS: Tiago F T Cerqueira; Rafael Sarmiento Perez; Maximilian Amsler; Nogueira, F; Silvana Botti; Miguel A L Marques;
PUBLISHED: 2015, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 11, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 14
8
TITLE: Insights into colour-tuning of chlorophyll optical response in green plants
AUTHORS: Joaquim Jornet Somoza; Joseba Alberdi Rodriguez; Bruce F Milne; Xavier Andrade; Miguel A L Marques; Fernando Nogueira; Micael J T Oliveira; James J P Stewart; Angel Rubio;
PUBLISHED: 2015, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 17, ISSUE: 40
INDEXED IN: Scopus WOS
10
TITLE: Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations
AUTHORS: Lianhua H He; Fang Liu; Geoffroy Hautier; Micael J T Oliveira; Miguel A L Marques; Fernando D Vila; Rehr, JJ; M Rignanese; Aihui H Zhou;
PUBLISHED: 2014, SOURCE: PHYSICAL REVIEW B, VOLUME: 89, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef
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