{ "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" [ [ 13.2455356 -2.0872095 2.2890407 ] [ -1.5709035 7.1229465 -4.8967979 ] [ -1.5971107 0.5315781 5.2184148 ] [ -7.1461405 2.7194501 -4.820457 ] [ -2.9313809 -8.2867652 2.2097994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.122168764313517e-08 -3.344078291162823e-09 3.667447523815004e-09 ] [ -2.516864881968819e-09 1.141221844753208e-08 -7.845535176800268e-09 ] [ -2.558853445451384e-09 8.516820109661154e-10 8.360822259079783e-09 ] [ -1.144937933238107e-08 4.357039407548963e-09 -7.723223570601737e-09 ] [ -4.69658998333389e-09 -1.327686157488434e-08 3.540488964507219e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.953199 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.075331277335217e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6777027 0.5375657 1.5393936 ] [ 0.7536633 3.0824075 0.7493275 ] [ -0.5797906 2.3141615 2.593243 ] [ 2.9828109 0.0781532 2.1082556 ] [ 2.7554435 1.8260215 0.4768187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.777027e-11 5.375657000000001e-11 1.5393936e-10 ] [ 7.536633000000001e-11 3.0824075e-10 7.493275e-11 ] [ -5.797906000000001e-11 2.3141615e-10 2.593243e-10 ] [ 2.9828109e-10 7.815320000000001e-12 2.1082556e-10 ] [ 2.7554435e-10 1.8260215e-10 4.768187e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.3e-06 -2.95e-05 8e-07 ] [ -2.42e-05 1.84e-05 7.2e-06 ] [ 6e-07 1.31e-05 -1e-07 ] [ -3e-06 9.9e-06 -5.4e-06 ] [ 3.29e-05 -1.19e-05 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.00937127942e-14 -4.726421070299999e-14 1.2817413072e-15 ] [ -3.877267454279999e-14 2.94800500656e-14 1.15356717648e-14 ] [ 9.613059803999998e-16 2.09885139054e-14 -1.602176634e-16 ] [ -4.806529901999999e-15 1.58615486766e-14 -8.6517538236e-15 ] [ 5.271161125859999e-14 -1.90659019446e-14 -4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.983578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.560851519931645e-18 } }