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4 Publications


2018 | Journal Article | LibreCat-ID: 23597
Kapil V, Rossi M, Marsalek O, et al. i-PI 2.0: A universal force engine for advanced molecular simulations. Computer Physics Communications. 2018:214-223. doi:10.1016/j.cpc.2018.09.020
LibreCat | DOI
 

2017 | Journal Article | LibreCat-ID: 13276
Rutkai G, Köster A, Guevara-Carrion G, et al. ms2: A Molecular Simulation Tool for Thermodynamic Properties, Release 3.0. Computer Physics Communications. 2017;221:343-351. doi:10.1016/j.cpc.2017.07.025
LibreCat | DOI
 

2009 | Journal Article | LibreCat-ID: 18636
Friedrich C, Schindlmayr A, Blügel S. Efficient calculation of the Coulomb matrix and its expansion around k=0 within the FLAPW method. Computer Physics Communications. 2009;180(3):347-359. doi:10.1016/j.cpc.2008.10.009
LibreCat | Files available | DOI | WoS | arXiv
 

2007 | Journal Article | LibreCat-ID: 18595
Freysoldt C, Eggert P, Rinke P, Schindlmayr A, Godby RW, Scheffler M. Dielectric anisotropy in the GW space–time method. Computer Physics Communications. 2007;176(1):1-13. doi:10.1016/j.cpc.2006.07.018
LibreCat | Files available | DOI | WoS | arXiv
 

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