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Update job_types.py
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theory/job_types.py

Lines changed: 1 addition & 1 deletion
Original file line numberDiff line numberDiff line change
@@ -1173,7 +1173,7 @@ def get_xtb(self):
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start = np.rad2deg(self.geometry.angle(*angle))
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stop = start + (steps - 1) * size
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out["scan"].append(
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"%i: %.3f, %.3f, %2i".format(
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"%i: %.3f, %.3f, %2i" % (
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len(out["constrain"]), start, stop, steps,
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)
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)

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