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Commit 0a27b706 authored by Rene Halver's avatar Rene Halver
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bug fixes: ScaFaCoS returns virial as 9-value array, requires copies to Lammps... 

bug fixes: ScaFaCoS returns virial as 9-value array, requires copies to Lammps 6-value array; fixed error in compuation of per-atom energy calculation
parent 953b2837
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