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POD_coefficients: 32
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-4.443926077098761418
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4.2507783817509592339
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-2.3176356302127896214
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-3.9221278398684784605
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0.83911958461214997129
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-0.79841449734252079029
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0.26378941721655152497
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-21.611634136626200586
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-15.666044232814460457
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-39.29944326792482201
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8.1344792452082685941
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-42.618960929128391513
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2.8389668623167838568
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3.7860858047706988927
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5.3302522869881912015
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0.068458969304951933221
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2.9641410087664388229
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0.093199096723738703019
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-0.18687412923621199434
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-0.24053991546811676061
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-0.16710193675730081186
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0.53880267211977672659
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0.022340165031980874916
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-0.0016838394567211768457
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0.024818837996861804751
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-0.005125945253867680157
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0.076934015079245715585
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-0.058872357353699972249
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-0.055300488883823724351
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-0.12649098515466200565
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0.11729161170526267166
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0.0026962161198949207916
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# DATE: 2022-11-28 UNITS: metal CONTRIBUTOR: Ngoc Cuong Nguyen, exapde@gmail.com CITATION: https://arxiv.org/abs/2209.02362
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# chemical element symbols
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species Ta
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# periodic boundary conditions
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pbc 1 1 1
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# inner cut-off radius
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rin 1.0
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# outer cut-off radius
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rcut 5.0
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# polynomial degrees for radial basis functions
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bessel_polynomial_degree 3
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inverse_polynomial_degree 6
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# one-body potential
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onebody 1
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# two-body linear POD potential
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twobody_number_radial_basis_functions 6
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# three-body linear POD potential
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threebody_number_radial_basis_functions 5
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threebody_number_angular_basis_functions 5
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# four-body linear SNAP potential
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fourbody_snap_twojmax 0
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# quadratic POD potential
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quadratic_pod_potential 0
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