PySCF only compatible with specific commit of xcfun library
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		| @@ -18,6 +18,7 @@ class Xcfun(CMakePackage): | ||||
|     version('master', branch='master') | ||||
|     version('2.0.0a6', | ||||
|             sha256='a51086490890393439f98c5e3e4e1622908fe934bbc5063b1d4363cc4c15496d') | ||||
|     version('pyscf', commit='355f42497a9cd17d16ae91da1f1aaaf93756ae8b') | ||||
| 
 | ||||
|     extends('python') | ||||
|     depends_on('cmake@3.11:', type='build') | ||||
|   | ||||
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