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1 parent 0b68c9d commit 4597da6Copy full SHA for 4597da6
1 file changed
scripts/sscha
@@ -148,7 +148,8 @@ minim.finalize(2)
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# Save the final dynamical matrix
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print ("Saving the final dynamical matrix in %s" % (minim.dyn_path + "_popuation%d_" % minim.population))
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-minim.dyn.save_qe(minim.dyn_path + "_population%d_" % minim.population)
+minim.dyn.save_qe('final_sscha_dyn_pop%d' % minim.population)
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+minim.dyn.structure.save_scf('final_sscha_structure_pop%d.scf' % minim.population)
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# Plot the results
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minim.plot_results(args.save_data, args.plot)
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