[Wien] [Wien2k User Group] B2/m symmetry to P1 symmetry

[Ghosh SUDDHASATTWA]

Dear Wien2k users, 

I have question on the limitation of Wien2k regarding monoclinic systems. In
case, we have I2/m symmetry or C2/m symmetry, then can we change it to P1
setting using softwares like Endeavour and then generate the structure from
the resulting structure file? Would it give the correct result? 

 

Suddhasattwa Ghosh 

 

 

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