Tomoki-YAMASHITA / CrySPY

CrySPY is a crystal structure prediction tool written in Python.
https://tomoki-yamashita.github.io/CrySPY_doc
MIT License
107 stars 38 forks source link

Could CrySPY generate 2D crystals? #8

Closed thu-wangz17 closed 3 years ago

thu-wangz17 commented 4 years ago

Hi. Could CrySPY generate 2D crystals randomly and how?

Tomoki-YAMASHITA commented 3 years ago

Sorry for late reply, I realized your comment just now. Currently CrySPY can NOT generate random 2D crystals. But, we will employ PyXtal library for structure generation in next version (0.9.0). The function to generate 2D crystal might be implemented in version 0.9.x.

thu-wangz17 commented 3 years ago

Thanks.