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Shouldn't be needed, but just in case: fft_fact initialized to 1,1,1

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giannozz 2019-04-26 11:50:20 +02:00
parent 8d5e473859
commit 15408fedfd
1 changed files with 1 additions and 1 deletions
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PW/src/symm_base.f90
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@ -32,7 +32,7 @@ MODULE symm_base
INTEGER :: &
s(3,3,48), &! symmetry matrices, in crystal axis
invs(48), &! index of inverse operation: S^{-1}_i=S(invs(i))
fft_fact(3), &! FFT dimensions must be multiple of fft_fact
fft_fact(3) = 1, &! FFT dimensions must be multiple of fft_fact
nrot, &! number of bravais lattice symmetries
spacegroup = 0, &! space group index, as read from input
nsym = 1, &! total number of crystal symmetries