{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3525325 -6.4435135 -5.1234588 ] [ -6.2135577 -4.5533601 2.5894268 ] [ 0.9553123 1.3106169 2.8870213 ] [ -2.3608564 9.2391676 -2.6884134 ] [ 0.524354 -2.560375 -0.1661273 ] [ 5.5346265 3.412479 -2.6241626 ] [ 3.9126538 -0.405015 5.1257141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.769172571172176e-09 -1.032364668550918e-08 -8.208685906992024e-09 ] [ -9.955216878931819e-09 -7.295287098303551e-09 4.148719080232958e-09 ] [ 1.530579032622676e-09 2.099839756005372e-09 4.625518030611623e-09 ] [ -3.782508929146053e-09 1.480277832437285e-08 -4.307313096525438e-09 ] [ 8.401077198229633e-10 -4.1021729654808e-09 -2.661652761366279e-10 ] [ 8.86744918316013e-09 5.467394072770963e-09 -4.204371966897743e-09 ] [ 6.26876244364428e-09 -6.489055640733121e-10 8.212299295924913e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2568188 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.322888204354191e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0330985 0.8812292 2.2574721 ] [ 0.966619 0.8979323 4.2959358 ] [ 2.2766101 2.6983391 4.8764389 ] [ 2.417842 3.2642244 2.6112063 ] [ 4.2835108 0.6804159 2.8630973 ] [ 4.624824 2.8329731 2.1251729 ] [ 4.1249806 1.3823285 5.0197326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0330985e-10 8.812292000000001e-11 2.2574721e-10 ] [ 9.66619e-11 8.979323000000001e-11 4.2959358e-10 ] [ 2.2766101e-10 2.6983391e-10 4.8764389e-10 ] [ 2.417842e-10 3.2642244e-10 2.6112063e-10 ] [ 4.2835108e-10 6.804159e-11 2.8630973e-10 ] [ 4.624824e-10 2.8329731e-10 2.1251729e-10 ] [ 4.1249806e-10 1.3823285e-10 5.0197326e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.55e-05 4.6e-06 -1.1e-06 ] [ -1.39e-05 -2.82e-05 2.07e-05 ] [ -1.17e-05 -1.1e-06 2.18e-05 ] [ 5.98e-05 2.8e-06 -2.5e-06 ] [ -2.38e-05 3.45e-05 -2e-05 ] [ -2.01e-05 -1.66e-05 -3.72e-05 ] [ -2.58e-05 3.9e-06 1.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.68772700384e-14 7.370012455680001e-15 -1.76239428288e-15 ] [ -2.227025502912e-14 -4.518138070656001e-14 3.316505605055999e-14 ] [ -1.874546646336e-14 -1.76239428288e-15 3.492745033344e-14 ] [ 9.581016192383999e-14 4.48609453824e-15 -4.005441552e-15 ] [ -3.813180357504e-14 5.52750934176e-14 -3.2043532416e-14 ] [ -3.220375007808e-14 -2.659613190528e-14 -5.960097029376001e-14 ] [ -4.133615681664e-14 6.24848882112e-15 2.915961449856e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }