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      A General Two‐Step Strategy–Based High‐Throughput Screening of Single Atom Catalysts for Nitrogen Fixation

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          Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set

          G Kresse, J. Furthmüller (1996)
          Article 0 comments Cited 18178 times – based on 0 reviews     Review now
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            Projector augmented-wave method

            P. Blöchl (1994)
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              From ultrasoft pseudopotentials to the projector augmented-wave method

              G Kresse, D Joubert (1999)
              Physical Review B, 59(3), 1758-1775
              Article 0 comments Cited 6511 times – based on 0 reviews     Review now
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                Author and article information

                Contributors
                Journal
                Title: Small Methods
                Abbreviated Title: Small Methods
                Publisher: Wiley
                ISSN (Print): 2366-9608
                ISSN (Electronic): 2366-9608
                Publication date Created: September 2019
                Publication date (Electronic): December 13 2018
                Publication date (Print): September 2019
                Volume: 3
                Issue: 9
                Page: 1800376
                Affiliations
                [1 ]School of Physics Southeast University Nanjing 211189 P. R. China
                [2 ]School of Chemistry Physics and Mechanical Engineering Science and Engineering Faculty Queensland University of Technology Gardens Point Campus Brisbane QLD 4001 Australia
                Article
                DOI: 10.1002/smtd.201800376
                SO-VID: 4c90340a-7a43-41a4-8610-3518939caebc
                Copyright © © 2019
                License:

                http://onlinelibrary.wiley.com/termsAndConditions#am

                http://onlinelibrary.wiley.com/termsAndConditions#vor

                http://doi.wiley.com/10.1002/tdm_license_1.1

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