diff --git a/examples/gpmdcov/input.in b/examples/gpmdcov/input.in index a5edb5f5..df5c58b3 100644 --- a/examples/gpmdcov/input.in +++ b/examples/gpmdcov/input.in @@ -26,8 +26,8 @@ Latte{ MDSteps= 3 ParamPath= "../latteTBparams" #CoordsFile= coords.ltt - #CoordsFile= coords_1032.dat - CoordsFile= coords_2088.dat + CoordsFile= coords_1032.dat + #CoordsFile= coords_2088.dat #CoordsFile= coords_2955.dat #CoordsFile= coords_10000.dat NlistEach= 20 @@ -58,7 +58,7 @@ GSP2{ #PartitionRefinement= SA NLGraphCut= 3.2 CovGraphFact= 3.7 - PartitionCount= 224 + PartitionCount= 128 GraphThreshold= 2.0e-3 ErrLimit= 1.0e-12 PartEach= 20