{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 38.4377328 -197.4618606 76.0404234 ] [ -120.3750576 103.3935394 -97.5373429 ] [ -124.6290056 288.291343 80.6707172 ] [ 160.5946033 -265.1985766 30.9075715 ] [ 45.9717272 70.9755548 -90.0813692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.158403735609538e-08 -3.163687791594852e-07 1.218301896109468e-07 ] [ -1.928621046031241e-07 1.656547129332383e-07 -1.562720517368258e-07 ] [ -1.996776806909751e-07 4.618936535390794e-07 1.292487381458619e-07 ] [ 2.573009209537593e-07 -4.248949627985792e-07 4.951938887098433e-08 ] [ 7.365482714446224e-08 1.137153754857465e-07 -1.443262648909673e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 205.07403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.28564819106215e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.3066423 -0.4944243 1.3577832 ] [ -0.3445481 2.3908584 1.0294584 ] [ 0.6724481 2.9715615 3.5869365 ] [ 2.0739798 0.5224141 3.8656573 ] [ 2.0796047 1.6358941 -0.8024873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3066423e-10 -4.944243e-11 1.3577832e-10 ] [ -3.445481000000001e-11 2.3908584e-10 1.0294584e-10 ] [ 6.724481e-11 2.9715615e-10 3.586936500000001e-10 ] [ 2.0739798e-10 5.224141e-11 3.8656573e-10 ] [ 2.0796047e-10 1.6358941e-10 -8.024873000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.52e-05 -1.1e-05 -6.2e-06 ] [ 2.1e-06 -2.22e-05 -4.15e-05 ] [ 1.73e-05 -5.3e-06 3.15e-05 ] [ 7.7e-06 2.39e-05 2e-07 ] [ -1.9e-06 1.46e-05 1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.037485117679999e-14 -1.7623942974e-14 -9.9334951308e-15 ] [ 3.364570931399999e-15 -3.55683212748e-14 -6.649033031099999e-14 ] [ 2.77176557682e-14 -8.4915361602e-15 5.046856397099999e-14 ] [ 1.23367600818e-14 3.82920215526e-14 3.204353268e-16 ] [ -3.0441356046e-15 2.33917788564e-14 2.5634826144e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.673165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.870247220782661e-18 } }