IALGO=48 (RMM-DIIS)”和“Therefore, if you have problems with IALGO=48 (ALGO=Fast)”关于ALGO...
ALGO = Normal will select, IALGO=38 (blocked Davidson block iteration scheme), whereas ALGO = Very Fast will select IALGO=48 (RMM-DIIS). A faily robust mixture of both algorithm is selected for ALGO = Fast. In this case IALGO=38 is used for the initial phase, and then VASP switches ...
IALGO=48 (RMM-DIIS)”和“Therefore, if you have problems with IALGO=48 (ALGO=Fast)”关于ALGO...