Dear user and developers of QE,
Can someone please explain what is the meaning of this error and how to fix
it?
Input is the same as in PHonon/example12 (qe-6.7) with putting SiH4 in the
middle of the ibrav = 1 with A = 20.0, plus setting lraman = .True.,
deltatau = 0.01.
Error in output:
...
Starting calculation of Raman coefficients
NEW-OLD atomic charge density approx. for the potential
negative rho (up, down): 1.334E-06 0.000E+00
Generating pointlists ...
new r_m : 0.0409 (alat units) 1.1598 (a.u.) for type 1
new r_m : 0.0409 (alat units) 1.1598 (a.u.) for type 2
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine make_pointlists (1):
inconsistent sizes
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
--
Best wishes,
Alex (she/her/hers),
phd candidate in chemical sciences
'I.. a universe of atoms, an atom in the universe' (Richard P. Feynman)
https://cpms.kaust.edu.sa/
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