当编译其他两个vasp版本,也就是std和gam,还是要用原本的设置。 The most interesting thing is, you can use the original setting to compile std and gam version of vasp correctly, which the compilation for ncl fails. This error has been also reported in forum in vasp, the link is shown below....
ERROR: non collinear calculations require that VASP is compiled without the flag -DNGXhalf and -DNGZhalf ERROR: non collinear calculations require that VASP is compiled 我运行541ncl时候就会出来这个~~~
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