{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3731034 5.7506623 -19.8844058 ] [ -1.7739688 -7.9763559 24.3957003 ] [ 6.2410464 -7.6953459 -7.149805 ] [ -13.9325929 24.5310749 -19.2431703 ] [ 23.8386187 -14.6100353 21.8816809 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.302825023582099e-08 9.213576691175956e-09 -3.185833009125992e-08 ] [ -2.842211337388631e-09 -1.277953094216014e-08 3.908622066870355e-08 ] [ 9.999258631408005e-09 -1.232930328994913e-08 -1.145525041427894e-08 ] [ -2.232247461150407e-08 3.93031146878737e-08 -3.083095756473292e-08 ] [ 3.81936775533057e-08 -2.340785698672272e-08 3.50583175617859e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.9730853 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.569937621704154e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1490843 1.0322675 0.8885933 ] [ 0.4355248 0.2463309 3.1496053 ] [ 1.7763043 -0.2677401 0.3273035 ] [ 1.5597215 2.7943893 1.1043311 ] [ 2.7432438 1.2172367 2.7088182 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.490843e-11 1.0322675e-10 8.885933e-11 ] [ 4.355248e-11 2.463309e-11 3.149605300000001e-10 ] [ 1.7763043e-10 -2.677401e-11 3.273035e-11 ] [ 1.5597215e-10 2.7943893e-10 1.1043311e-10 ] [ 2.7432438e-10 1.2172367e-10 2.7088182e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.5e-06 -4.1e-06 2.21e-05 ] [ 8.2e-06 5.9e-06 -1.48e-05 ] [ 6.2e-06 -3.72e-05 -2.3e-05 ] [ 5.1e-06 3.54e-05 -1.6e-06 ] [ -1.2e-05 0.0 1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2016324656e-14 -6.568924145279999e-15 3.540810331968e-14 ] [ 1.313784829056e-14 9.45284206272e-15 -2.371221398784e-14 ] [ 9.93349504896e-15 -5.960097029376001e-14 -3.68500622784e-14 ] [ 8.17110076608e-15 5.671705237632e-14 -2.56348259328e-15 ] [ -1.92261194496e-14 0.0 2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.809519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.052311186549339e-18 } }