unit test for extract() in bond-fene_expand.yaml
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@ -17,7 +17,12 @@ bond_coeff: ! |
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4 650 2.4 0.015 1.2 0.15
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5 450 2 0.018 1 0.09
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equilibrium: 5 1.5550000000000002 1.117 1.321 1.3139999999999998 1.06
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extract: ! ""
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extract: ! |
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k 1
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r0 1
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epsilon 1
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sigma 1
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shift 1
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natoms: 29
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init_energy: 5926.020859124294
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init_stress: ! |-
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