<div>Dear users,</div> <div> </div> <div>Bond overlap population is defined as a measure of the shared electron density between 2 atoms. I find no PWSCF-examples calculating overlap population. My question is whether PWSCF can calculate this quantity. If yes, can someone teach me how to calculate the overlap population?</div> <div> </div> <div>Thank you very much,</div> <div> </div> <div>opvu</div><p>
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