unit test for extract() in bond-nonlinear.yaml
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@ -17,7 +17,10 @@ bond_coeff: ! |
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4 650.0 1.2 1.4
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5 450.0 1.0 1.1
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equilibrium: 5 1.5 1.1 1.3 1.2 1
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extract: ! ""
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extract: ! |
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lamda 1
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epsilon 1
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r0 1
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natoms: 29
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init_energy: 1.9451728032820943
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init_stress: ! |-
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