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PME in xTB QM/MM#93

Merged
fishjojo merged 12 commits intofishjojo:mlxtbfrom
MoleOrbitalHybridAnalyst:fishjojo-mlxtb
Mar 2, 2026
Merged

PME in xTB QM/MM#93
fishjojo merged 12 commits intofishjojo:mlxtbfrom
MoleOrbitalHybridAnalyst:fishjojo-mlxtb

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@MoleOrbitalHybridAnalyst

Implement the particle mesh Ewald for QM-MM interactions

@fishjojo fishjojo merged commit 9e6e6e1 into fishjojo:mlxtb Mar 2, 2026
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