{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0066603 -1.0194746 -2.2648065 ] [ 0.9038593 -5.7728223 -3.3155474 ] [ 0.2127721 -3.0504585 6.4411345 ] [ -11.3340926 7.2552456 5.2431552 ] [ 8.6422487 -5.5579854 -16.1640936 ] [ 0.9177322 16.5516733 -2.9616917 ] [ 5.6641406 -8.4061781 13.0218495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.02155414703543e-09 -1.633378383076496e-09 -3.628620054831321e-09 ] [ 1.448142250883596e-09 -9.249081001294137e-09 -5.312092573199451e-09 ] [ 3.408984869871113e-10 -4.887373331686688e-09 1.031983519235127e-08 ] [ -1.815921833131231e-08 1.162418497425131e-08 8.400460749875597e-09 ] [ 1.384640893235688e-08 -8.904874339993143e-09 -2.589773307570894e-08 ] [ 1.470369087109415e-09 2.651870421486167e-08 -4.745153238851738e-09 ] [ 9.07495372101074e-09 -1.346818213306251e-08 2.086330300036458e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9030762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.105994739036151e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8909695 2.9355643 2.7686652 ] [ 2.5880965 2.3030118 1.0553169 ] [ 2.071165 1.7782502 4.6832051 ] [ 1.7471047 5.139671 3.4666301 ] [ 4.3543487 3.727263 2.0886404 ] [ 3.2088482 5.9181844 1.5544084 ] [ 3.5746281 3.7964454 4.4264758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.909695e-11 2.9355643e-10 2.7686652e-10 ] [ 2.5880965e-10 2.3030118e-10 1.0553169e-10 ] [ 2.071165e-10 1.7782502e-10 4.683205100000001e-10 ] [ 1.7471047e-10 5.139671e-10 3.4666301e-10 ] [ 4.3543487e-10 3.727263e-10 2.0886404e-10 ] [ 3.2088482e-10 5.9181844e-10 1.5544084e-10 ] [ 3.5746281e-10 3.7964454e-10 4.4264758e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-05 -3.03e-05 2.5e-06 ] [ -3.43e-05 -3.73e-05 -4.2e-06 ] [ 2.72e-05 3.71e-05 -2.3e-06 ] [ 1.63e-05 6.3e-06 -3.33e-05 ] [ -3.5e-05 2.72e-05 -1.21e-05 ] [ 3.41e-05 1.97e-05 4.44e-05 ] [ -4.13e-05 -2.28e-05 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.287182892199999e-14 -4.854595201019999e-14 4.005441585e-15 ] [ -5.49546585462e-14 -5.97611884482e-14 -6.729141862799999e-15 ] [ 4.35792044448e-14 5.94407531214e-14 -3.685006258199999e-15 ] [ 2.61154791342e-14 1.00937127942e-14 -5.33524819122e-14 ] [ -5.607618218999999e-14 4.35792044448e-14 -1.93863372714e-14 ] [ 5.46342232194e-14 3.15628796898e-14 7.11366425496e-14 ] [ -6.61698949842e-14 -3.65296272552e-14 8.010883169999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }