{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6999152 -17.1006236 -0.8557919 ] [ -4.2201169 11.4669947 -8.0729742 ] [ -10.3853151 3.8044902 14.617538 ] [ 2.7289812 -2.5958692 1.0391398 ] [ 20.576366 4.4250079 -6.7279116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393880073638256e-08 -2.739821933302073e-08 -1.371129774450012e-09 ] [ -6.761372634222972e-09 1.837215081917751e-08 -1.293433052356158e-08 ] [ -1.663910905286121e-08 6.095465252502716e-09 2.341987763725559e-08 ] [ 4.37230987724273e-09 -4.159040942894799e-09 1.664885493302788e-09 ] [ 3.296697254622402e-08 7.089644204235305e-09 -1.077930267232912e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.07186979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.151480972798056e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.4563725 -0.0252243 2.3439696 ] [ 1.0128808 3.460635 0.9218657 ] [ -0.5697594 2.0532128 1.9448691 ] [ 2.6731971 0.0976526 1.5676212 ] [ 3.0171388 2.2520334 0.6887127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.563725000000001e-11 -2.52243e-12 2.3439696e-10 ] [ 1.0128808e-10 3.460635e-10 9.218657e-11 ] [ -5.697594e-11 2.0532128e-10 1.9448691e-10 ] [ 2.6731971e-10 9.765260000000001e-12 1.5676212e-10 ] [ 3.0171388e-10 2.2520334e-10 6.887127e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 3.9e-06 -1.1e-06 ] [ 9.9e-06 5.4e-06 -5.2e-06 ] [ -4.5e-06 -9.8e-06 5.1e-06 ] [ 2.2e-06 1.14e-05 -4.7e-06 ] [ -6.5e-06 -1.08e-05 6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 6.24848882112e-15 -1.76239428288e-15 ] [ 1.586154854592e-14 8.65175375232e-15 -8.33131842816e-15 ] [ -7.2097947936e-15 -1.570133088384e-14 8.17110076608e-15 ] [ 3.52478856576e-15 1.826481347712e-14 -7.53023011776e-15 ] [ -1.04141480352e-14 -1.730350750464e-14 9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }