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      Ab initio molecular dynamics simulation of liquid water: Comparison of three gradient‐corrected density functionals

      Author(s): , ,
      Publication date Created:
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      Journal: The Journal of Chemical Physics
      Publisher: AIP Publishing

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          Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

          David Vanderbilt (1990)
          Article 0 comments Cited 3421 times – based on 0 reviews     Review now
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            A new mixing of Hartree–Fock and local density-functional theories

            Axel D. Becke (1993)
            Article 0 comments Cited 2056 times – based on 0 reviews     Review now
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              Rotation‐Vibration Spectra of Deuterated Water Vapor

              Earle K. Plyler, W. Benedict, N. Gailar (1956)
              Article 0 comments Cited 361 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: July 15 1996
                Publication date (Print): July 15 1996
                Volume: 105
                Issue: 3
                Pages: 1142-1152
                Article
                DOI: 10.1063/1.471957
                SO-VID: 6ac883ae-072b-413f-bfc0-5a97a18572fa
                Copyright © © 1996
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