{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8080348 -31.9189615 24.2644502 ] [ 17.9297281 34.6521928 -36.5121645 ] [ -54.2135605 9.9146402 21.779323 ] [ 78.5441364 12.8681017 68.263089 ] [ -26.4522692 -25.5159733 -77.7946976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.532726398601886e-08 -5.113981429684559e-08 3.887593514729663e-08 ] [ 2.872659141579321e-08 5.551893362102303e-08 -5.849893681866428e-08 ] [ -8.685969987904534e-08 1.588500486295708e-08 3.489432241493877e-08 ] [ 1.258415800777889e-07 2.061697186767568e-08 1.093695261604624e-07 ] [ -4.238120762851787e-08 -4.088109621502787e-08 -1.246408467438159e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 46.873005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.509883337636516e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8194836 0.254231 3.0881842 ] [ 1.146771 3.0006867 0.3671039 ] [ -0.3851474 1.6211775 1.5369023 ] [ 3.1318768 0.7481557 2.9235002 ] [ 1.862427 0.7937529 0.9081063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.194836e-11 2.54231e-11 3.0881842e-10 ] [ 1.146771e-10 3.000686700000001e-10 3.671039e-11 ] [ -3.851474e-11 1.6211775e-10 1.5369023e-10 ] [ 3.1318768e-10 7.481557e-11 2.9235002e-10 ] [ 1.862427e-10 7.937529e-11 9.081063000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.58e-05 1.59e-05 1.04e-05 ] [ 1.88e-05 -7.3e-06 2.47e-05 ] [ 1.34e-05 -2.76e-05 -4.8e-06 ] [ 2.48e-05 1.16e-05 7.6e-06 ] [ -3.12e-05 7.5e-06 -3.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.133615715719999e-14 2.54746084806e-14 1.66626369936e-14 ] [ 3.012092071919999e-14 -1.16958894282e-14 3.95737628598e-14 ] [ 2.14691668956e-14 -4.42200750984e-14 -7.690447843199998e-15 ] [ 3.97339805232e-14 1.85852489544e-14 1.21765424184e-14 ] [ -4.998791098079999e-14 1.2016324755e-14 -6.072249442859999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.06157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252911889135538e-18 } }