计算能带出现“APPLICATION TERMINATED WITH THE EXIT STRING: Killed (signal 9)” 第一性原理 Vasp&MedeA 小木虫 论坛
APPLICATION TERMINATED WITH THE EXIT STRING: Killed (signal 9) 请各位帮我看看问题是出在哪里。谢谢。 incar文件如下: PREC = Medium ISTART = 1 ICHARG = 11 ISPIN = 2 ENCUT = 400.0 ISMEAR = 1 SIGMA = 0.2 NELM = 500 NELMIN = 5 NELMDL = -8 EDIFF = 1E-4 IALGO = 48...