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      Perspective: How good is DFT for water?

      Author(s): 1 , 2 , 3 , 1 , 2 , 3 , 4 , 1 , 2 , 3
      Publication date Created:
      Publication date (Print):
      Journal: The Journal of Chemical Physics
      Publisher: AIP Publishing

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          Generalized Gradient Approximation Made Simple

          John P Perdew, Kieron Burke, Matthias Ernzerhof (1997)
          Article 0 comments Cited 27954 times – based on 0 reviews     Review now
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            Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set

            G Kresse, J. Furthmüller (1996)
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              Exchange and correlation in atoms, molecules, and solids by the spin-density-functional formalism

              O Gunnarsson, B. Lundqvist (1976)
              Article 0 comments Cited 1070 times – based on 0 reviews     Review now
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                Author and article information

                Journal
                Title: The Journal of Chemical Physics
                Abbreviated Title: The Journal of Chemical Physics
                Publisher: AIP Publishing
                ISSN (Print): 0021-9606
                ISSN (Electronic): 1089-7690
                Publication date Created: April 07 2016
                Publication date (Print): April 07 2016
                Volume: 144
                Issue: 13
                Page: 130901
                Affiliations
                [1 ]London Centre for Nanotechnology, Gordon St., London WC1H 0AH, United Kingdom
                [2 ]Thomas Young Centre, University College London, London WC1H 0AH, United Kingdom
                [3 ]Department of Physics and Astronomy, University College London, London WC1E 6BT, United Kingdom
                [4 ]Department of Earth Sciences, University College London, London WC1E 6BT, United Kingdom
                Article
                DOI: 10.1063/1.4944633
                PubMed ID: 27059554
                SO-VID: 9eb22617-87a5-45ef-946b-ccf7ad52286f
                Copyright © © 2016
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                https://publishing.aip.org/authors/rights-and-permissions

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