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Fixed an error with a newer numpy version
1 parent 5e19231 commit 579ab81

1 file changed

Lines changed: 3 additions & 3 deletions

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Modules/SchaMinimizer.py

Lines changed: 3 additions & 3 deletions
Original file line numberDiff line numberDiff line change
@@ -425,9 +425,9 @@ def minimization_step(self, custom_function_gradient = None, timer=None):
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CC.symmetries.CustomASR(dyn_grad[0,:,:])
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else:
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if timer is not None:
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timer.execute_timed_function(qe_sym.SymmetrizeFCQ, dyn_grad, np.array(self.dyn.q_stars), asr = "custom")
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timer.execute_timed_function(qe_sym.SymmetrizeFCQ, dyn_grad, self.dyn.q_stars, asr = "custom")
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else:
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qe_sym.SymmetrizeFCQ(dyn_grad, np.array(self.dyn.q_stars), asr = "custom")
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qe_sym.SymmetrizeFCQ(dyn_grad, self.dyn.q_stars, asr = "custom")
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#qe_sym.SymmetrizeFCQ(err, np.array(self.dyn.q_stars), asr = "custom")
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# Just divide the error by the square root the number of symmetries
@@ -509,7 +509,7 @@ def minimization_step(self, custom_function_gradient = None, timer=None):
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#print "applying sum rule and symmetries:"
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#qe_sym.SymmetrizeFCQ(dyn_grad, np.array(self.dyn.q_stars), asr = "custom")
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#qe_sym.SymmetrizeFCQ(dyn_grad, self.dyn.q_stars, asr = "custom")
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#print "SECOND DIAG:", np.linalg.eigvalsh(dyn_grad[0, :, :])
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