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1. CP2K basics - institut de physique et de chimie des materiaux de

CP2K http cp2k berlios de Basic tutorial to CP2K calculations S bastien LE ROUX sebastien leroux ipcms unistra fr INSTITUT DE PHYSIQUE ET DE CHIMIE DES MAT RIAUX DE STRASBOURG D PARTEMENT DES MAT RIAUX ORGANIQUES 23 RUE DU LOESS BP43 F 67034 STRASBOURG CEDEX 2 FRANCE Contents Contents List of tables 1 CP2K basics 1 1 General ideas on the CP2K method 2 2 nr nn nn 1 2 Variables and include files 1 3 The GLOBAL s
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1. CP2K basics - institut de physique et de chimie des materiaux de

CP2K http cp2k berlios de Basic tutorial to CP2K calculations S bastien LE ROUX sebastien leroux ipcms unistra fr INSTITUT DE PHYSIQUE ET DE CHIMIE DES MAT RIAUX DE STRASBOURG D PARTEMENT DES MAT RIAUX ORGANIQUES 23 RUE DU LOESS BP43 F 67034 STRASBOURG CEDEX 2 FRANCE Contents Contents List of tables 1 CP2K basics 1 1 General ideas on the CP2K method 2 2 nr nn nn 1 2 Variables and include files 1 3 The GLOBAL s
PDF Manual ENGLISH


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