Update bader tools - #79
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pxlxingliang
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Dec 15, 2025
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Tools for calculating Bader charges are updated:
net_chargesare changed tonet_bader_chargesto be more self-explained and be consistent with tool wrapper.bader_charge_results.csvcontainingnet_bader_chargesandatom_labelswill be returned, following developer of MatMaster's request.