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Performance of the Vienna ab initio simulation package (VASP) in chemical applications

Guangyu SunDepartment of Chemistry, Georgetown University, Washington, DC 20057-1227, USAJ. KürtiDepartment of Biological Physics, Eötvös University, Budapest, Pázmány P. sétány 1/A, H-1117 HungaryPéter RajczyDepartment of Biological Physics, Eötvös University, Budapest, Pázmány P. sétány 1/A, H-1117 HungaryMiklós KertészDepartment of Chemistry, Georgetown University, Washington, DC 20057-1227, USAJürgen HäfnerInstitute for Materials Physics, University of Vienna, Sensengasse 8/12, A-1090 Vienna, AustriaGeorg KresseInstitute for Materials Physics, University of Vienna, Sensengasse 8/12, A-1090 Vienna, Austria
2003en
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