{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6847421 -7.614797 -13.4397248 ] [ -74.4898744 -74.1994019 92.5202076 ] [ -14.7466952 -13.6093131 3.0444565 ] [ -8.2343364 24.736812 5.6221045 ] [ 93.7861638 70.6867001 -87.7470437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.903607694936091e-09 -1.22002498260533e-08 -2.153281304195032e-08 ] [ -1.193459362332748e-07 -1.188805479809552e-07 1.482337147895492e-07 ] [ -2.362681047815995e-08 -2.18045234536101e-08 4.877757067529421e-09 ] [ -1.319286137657568e-08 3.96327421860508e-08 9.00760446380625e-09 ] [ 1.502620002328566e-07 1.132525792347854e-07 -1.405862631187169e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 12.405641 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.987602813999239e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0738539 2.1967132 1.9524761 ] [ 2.4150571 2.127252 4.7527491 ] [ -0.0252855 2.1445484 3.6287382 ] [ 1.3697501 4.4380262 3.5156544 ] [ 3.9310586 3.6967771 3.1851783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0738539e-10 2.1967132e-10 1.9524761e-10 ] [ 2.4150571e-10 2.127252e-10 4.7527491e-10 ] [ -2.52855e-12 2.1445484e-10 3.6287382e-10 ] [ 1.3697501e-10 4.4380262e-10 3.5156544e-10 ] [ 3.9310586e-10 3.6967771e-10 3.1851783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-05 1.56e-05 4.05e-05 ] [ -2.51e-05 -9.2e-06 -2.28e-05 ] [ 5.67e-05 1.21e-05 -1.6e-06 ] [ 1.11e-05 -1.58e-05 -1.5e-05 ] [ -3.07e-05 -2.6e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9226119608e-14 2.49939554904e-14 6.4888153677e-14 ] [ -4.02146335134e-14 -1.47400250328e-14 -3.65296272552e-14 ] [ 9.08434151478e-14 1.93863372714e-14 -2.5634826144e-15 ] [ 1.77841606374e-14 -2.53143908172e-14 -2.403264951e-14 ] [ -4.91868226638e-14 -4.165659248399999e-15 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.92185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.71117926740529e-18 } }