Fatal error in PMPI_Allgatherv: Internal MPI error! 2015-11-05

A new version of VASP, denoted vasp.5.3.5 31Mar14 was released in the beginning of April. Swedish HPC users can find 5.3.5 installed on NSC’s Trio ...

(5378)次阅读|(0)个评论

HSE+GW+BSE几类计算的关键词小结 2014-06-27

GW NOMEGA= integer ！ spcifies the number of frequency grid points NOMEGA= integer ！ spcifies the number of frequency points along real axis ...

(9443)次阅读|(0)个评论

查看更多