{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9031057 1.0288455 0.2443021 ] [ -3.1748063 -0.88368 5.3611011 ] [ 5.2017913 -1.354644 -3.3845761 ] [ 1.0158942 1.6777452 -1.7838123 ] [ -2.1397734 -0.4682667 -0.4370148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.446934850572214e-09 1.648392220096047e-09 3.914151162571313e-10 ] [ -5.086600471335993e-09 -1.41581144793312e-09 8.589430914931697e-09 ] [ 8.334188475804483e-09 -2.170378964188296e-09 -5.422688743414847e-09 ] [ 1.627641949856123e-09 2.688044157245656e-09 -2.857982386501798e-09 ] [ -3.428294943534736e-09 -7.502459652202877e-10 -7.001749012721831e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.120234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.941875571341235e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.693715 1.7351129 0.4684411 ] [ 1.7649408 1.7997859 2.6931215 ] [ 3.1226655 1.3046298 0.5940738 ] [ 2.1797696 3.6405416 0.9801948 ] [ 4.0178753 2.7615228 2.3764766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.93715e-11 1.7351129e-10 4.684411e-11 ] [ 1.7649408e-10 1.7997859e-10 2.6931215e-10 ] [ 3.1226655e-10 1.3046298e-10 5.940738e-11 ] [ 2.1797696e-10 3.6405416e-10 9.801948000000001e-11 ] [ 4.0178753e-10 2.7615228e-10 2.3764766e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.5e-06 4.5e-06 5.7e-06 ] [ 2.5e-06 -9.3e-06 1.31e-05 ] [ 2e-07 9.6e-06 -1.1e-05 ] [ 1.34e-05 -9e-06 -1.57e-05 ] [ -1.17e-05 4.1e-06 7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.209794853e-15 7.209794853e-15 9.1324068138e-15 ] [ 4.005441585e-15 -1.49002426962e-14 2.09885139054e-14 ] [ 3.204353268e-16 1.53808956864e-14 -1.7623942974e-14 ] [ 2.14691668956e-14 -1.4419589706e-14 -2.515417315379999e-14 ] [ -1.87454666178e-14 6.568924199399999e-15 1.26571954086e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }