change chi to chi0 in improper-cossq.yaml
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@ -15,7 +15,7 @@ improper_coeff: ! |
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2 45.0 59.5
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extract: ! |
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k 1
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chi 1
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chi0 1
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natoms: 29
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init_energy: 47.901206451962224
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init_stress: ! |-
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