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  1. .gitattributes +25 -0
  2. 1_data_prepare/data/disp-01/reconstruction/aohamiltonian/hamiltonians.h5 +3 -0
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  15. 1_data_prepare/data/disp-05/reconstruction/aohamiltonian/overlaps.h5 +3 -0
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  26. 1_data_prepare/data/disp-10/reconstruction/aohamiltonian/hamiltonians.h5 +3 -0
  27. 1_data_prepare/data/disp-10/reconstruction/aohamiltonian/overlaps.h5 +3 -0
  28. 1_data_prepare/data/disp-10/reconstruction/aohamiltonian/rc.h5 +3 -0
  29. 1_data_prepare/data/disp-10/reconstruction/aohamiltonian/rh.h5 +3 -0
  30. 1_data_prepare/data/disp-10/scf/VSC +3 -0
  31. 1_data_prepare/data/disp-10/scf/diamond.save/charge-density.dat +3 -0
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  38. 1_data_prepare/data/disp-22/scf/VSC +3 -0
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