non-spinadapted and bcs calculations enabled#1
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zhengbx wants to merge 28 commits intosanshar:masterfrom
Open
non-spinadapted and bcs calculations enabled#1zhengbx wants to merge 28 commits intosanshar:masterfrom
zhengbx wants to merge 28 commits intosanshar:masterfrom
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…apted not work now
…ions in pdm calcualtions
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