标题: 求助：vasp最新版能否用metagga计算光学性质 [打印本页] 作者Author: shinkon 时间: 2022-8-30 20:49 标题: 求助：vasp最新版能否用metagga计算光学性质 如题，我所用的超算上安装的版本是5.4.4，加入metagga时提示：You have switched on METAGGA and linear response routines. || This combination is currently not supported. |
| If you have selected LOPTICS=.TRUE., VASP will continue but some |
| matrix elements [H,r] are neglected (you might try to use |
| LPEAD=.TRUE. which works irrespective of H).