Publications

Showing entries 80 - 100 out of 573

2017


Schäfer T, Kresse G. MP2 correlation energy for crystalline solids: A low complexity, high performance algorithm. 2017. Poster session presented at Austrian HPC Meeting 2017, Grundlsee, Austria.


Reticcioli M. Polaron-mediated surface reconstruction in the reduced Rutile TiO2 (110) surface. 2017. Poster session presented at Winter School "Computational Magnetism", Vienna, Austria.


Wende F, Marsman M, Zhao Z, Kim J. Porting VASP from MPI to MPI+OpenMP [SIMD]: optimization strategies, insights and feature proposals. In Scaling OpenMP for Exascale Performance and Portability - 13th International Workshop on OpenMP, IWOMP 2017, Proceedings. Vol. 10468 LNCS. Springer. 2017. p. 107-122. (Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)). doi.org/10.1007/978-3-319-65578-9_8


2016


Kim B. Computational methods towards engineering novel correlated materials. 2016. Poster session presented at CECAM workshop: Computational methods towards engineering novel correlated material, Lausanne, Switzerland.


Li R, Xu Y, He J, Ullah S, Li J, Liu J-M et al. Weyl Ferroelectric Semimetal. arXiv.org. 2016 Oct 23.


Liu P, Kaltak M, Klimes J, Kresse G. Constrained random phase approximation and Cubic scaling GW. 2016. Poster session presented at What about U? - Effects of Hubbard Interactions and Hund’s Coupling in Solids, Trieste, Italy.


Kim B. Metal-to-insulator transition in NaOsO3. 2016. Poster session presented at What about U? - Effects of Hubbard Interactions and Hund’s Coupling in Solids, Trieste, Italy.


Showing entries 80 - 100 out of 573