Re: [Pw_forum] force system to charge transferring

Dear Zara, Please have a look at this tutorial http://theossrv1.epfl.ch/Main/OxidationStates Regards, Mostafa MIT ___ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum

[Pw_forum] force system to charge transferring

Dear all, I study the interaction between 2 molecule. My system is totally natural ​,​ I would like to study the effect of charge transferring between 2 molecules or 2 atoms. Would you please help me, how can I ​force the system to transfer the charge between different atoms ? I really appreciate