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Austrian HPC Consortium Meets Demanding Inter-node Communication Challenge
A substantial amount of the compute resources will be used for computational materials science, which has a very strong tradition in Austria. Two of the most important and widely used codes in this area were developed in Vienna, the WIEN2k package and ...
Influence of oxygen vacancies on phase transformation of ZnO nanosheets
The calculations on the ZnO nanosheets are carried out using the density functional theory method implemented in the Wien2k code [7] and utilizing the revised Perdew-Burke-Ernzerholf (PBE)sol generalized gradient approximation (GGA) parametrization ...
Research Computing Task Force Report
An initial summary of software to target comes from the cluster survey: compilers (e.g., Intel, Portland Group), Gaussian, Molpro, WIEN2k, CHARMM, GAMESS, EMBOSS, NCBI Blast, molden, ADF, Dacapo, Fluent, Gambit, NMRPipe, Rosetta, Simpson, and ...
Detection of magnetic circular dichroism using a transmission electron microscope
For the simulations we used the electronic structure calculated with the WIEN2k code—a full-potential, fully relativistic augmented plane wave code based on density functional theory.
مجله پژوهش فيزيك ايران
مگيران با انبوه مخاطبين در مراکز دانشگاهي و سازمانها و رتبه 7 گوگل، فضاي مناسبي برای اطلاع رساني همايش ها، خدمات تخصصي و افزايش رتبه پايگاه هاي علمي است. مشاهده تعرفه تبليغات · Check Page Rank ...

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