[Pw_forum] regarding to calculate oxidation state
Raj kamal
rajkamalloyola at gmail.com
Wed Sep 30 18:48:35 CEST 2015
dear QE experts
i am working on Lithium ion batteries. In this i need to calculate
oxidation state of particular atoms Mn in such as LiMn2O4 materials. please
guide me how to calculate oxidation state for particular material in QE and
tags which i need to use.thanks in advance.
--
*Best regards,*
*Rajkamal.A.*
*Research Scholar,(SRM UNIV).*
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