unit test for extract() in angle-fourier_simple.yaml
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@ -16,7 +16,10 @@ angle_coeff: ! |
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3 50.0 1.0 3.0
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4 100.0 -0.5 1.5
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equilibrium: 4 3.141592653589793 1.5707963267948966 1.0471975511965976 2.0943951023931953
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extract: ! ""
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extract: ! |
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k 1
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C 1
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N 1
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natoms: 29
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init_energy: 2474.0748013590646
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init_stress: ! |-
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