On Sat, Sep 9, 2017 at 8:36 AM, Madhurya Chandel <[email protected]> wrote:
I have used CIF file no. 5910028 to get atomic position and other details > using virtual NanoLab. > your input has Fe-O distance 0.17 A, O-O distance 0.28 A Paolo -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216 <+39%200432%20558216>, fax +39-0432-558222 <+39%200432%20558222>
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