Update ESolver, delete pelec->charge, instead using chr defined in ESolver_fp directly #5963
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Qianruipku
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Mar 6, 2025
Fisherd99
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Mar 31, 2025
…olver_fp directly (deepmodeling#5963) * reorganize esolver_ks_lcao.h * delete some useless files in esolver_ks.h * change pelec->charge to this->chr * will delete pelec->charge in near future, we just directly use chr defined in esolver_fp * fix problem in ML_KEDF * update this->chr
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Update ESolver, delete pelec->charge, instead using chr defined in ESolver_fp directly