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Fix in reading in sumk_lda

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Priyanka Seth 2014-11-13 17:02:23 +01:00
parent 948db7744f
commit 1e4b103ba7
1 changed files with 1 additions and 2 deletions
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python/sumk_lda.py
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@ -153,7 +153,7 @@ class SumkLDA:
else: else:
value_read['%s'%it] = False value_read['%s'%it] = False
else: else:
mpi.report("Loading failed: No %s subgroup in HDF5!"%subgrp) if (len(things_to_read) != 0): mpi.report("Loading failed: No %s subgroup in HDF5!"%subgrp)
subgroup_present = False subgroup_present = False
value_read = False value_read = False
@ -415,7 +415,6 @@ class SumkLDA:
a_list = [a for a,al in self.gf_struct_corr[self.invshellmap[ish]] ] a_list = [a for a,al in self.gf_struct_corr[self.invshellmap[ish]] ]
for a in a_list: for a in a_list:
dm = dens_mat[ish][a] dm = dens_mat[ish][a]
dmbool = (abs(dm) > threshold) # gives an index list of entries larger that threshold dmbool = (abs(dm) > threshold) # gives an index list of entries larger that threshold