I am using mcsqs to generate a structure for VASP run, but waiting until mcsqs generate a best structure cost a lot of time. I want to calculate the energy of each structure that generated by mcsqs and compare the difference among them. I saw someone in a video using mcsqs generate bestsqs_1.out, bestsqs_2.out automatically. I don’t know much about programming. I want to know how can I make it. Thanks a lot for your help.
You can parallel run MCSQS.
thanks for your reply
But as I know MCSQS don`t support parallel run, the following is the website on youtube https://youtu.be/lwtsJ2fhOLw
Thanks for your reply!!!It`s a lot of help of your sharing!!!