{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.180338 1.724614 2.454285 ] [ 2.279675 2.151595 5.035575 ] [ 1.206438 3.673046 1.250197 ] [ 2.791298 3.409437 3.168578 ] [ 3.407643 1.775427 1.527211 ] [ 3.723971 4.511514 1.482617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.180338e-10 1.724614e-10 2.454285e-10 ] [ 2.279675e-10 2.151595e-10 5.035575e-10 ] [ 1.206438e-10 3.673046e-10 1.250197e-10 ] [ 2.791298e-10 3.409437e-10 3.168578e-10 ] [ 3.407643e-10 1.775427e-10 1.527211e-10 ] [ 3.723971e-10 4.511514e-10 1.482617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8938362 -12.206878 -1.2504203 ] [ 0.2545624 -1.5607181 6.2940372 ] [ -18.4198994 10.4633161 -11.0828977 ] [ 8.4280358 10.1126864 17.7911444 ] [ 14.0441113 -17.4911598 -6.6206553 ] [ 8.5870261 10.6827534 -5.1312081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.065820291206472e-08 -1.955757454455786e-08 -2.003394170833722e-09 ] [ 4.07853925814738e-10 -2.500546051479397e-09 1.008415925228549e-08 ] [ -2.951193217616795e-08 1.676408043146024e-08 -1.775675958565809e-08 ] [ 1.350320191802543e-08 1.620230972356212e-08 2.850455561495685e-08 ] [ 2.25011467847731e-08 -2.80239273022368e-08 -1.060745913603561e-08 ] [ 1.37579324596194e-08 1.711565774325171e-08 -8.221101654279589e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.5673103 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.919814403399036e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.294401 1.5097633 2.3311518 ] [ 1.9436851 2.2920229 4.4923726 ] [ 0.9410096 3.7538594 1.2913594 ] [ 3.4353877 4.0808538 3.9483977 ] [ 3.5670227 1.5650013 1.2947289 ] [ 3.407857 4.0441323 1.5604526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.294401e-10 1.5097633e-10 2.331151800000001e-10 ] [ 1.9436851e-10 2.2920229e-10 4.4923726e-10 ] [ 9.410096e-11 3.7538594e-10 1.2913594e-10 ] [ 3.4353877e-10 4.0808538e-10 3.9483977e-10 ] [ 3.5670227e-10 1.5650013e-10 1.2947289e-10 ] [ 3.407857e-10 4.0441323e-10 1.5604526e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.38e-05 2.48e-05 -3.79e-05 ] [ -3e-05 -9e-07 -6.7e-06 ] [ -1.21e-05 -1.9e-06 3.04e-05 ] [ 2.89e-05 3.6e-06 -3.08e-05 ] [ -4.4e-06 2.12e-05 3.15e-05 ] [ -2.62e-05 -4.68e-05 1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.017533599104001e-14 3.973398019584e-14 -6.072249392832e-14 ] [ -4.8065298624e-14 -1.44195895872e-15 -1.073458335936e-14 ] [ -1.938633711168e-14 -3.04413557952e-15 4.870616927232e-14 ] [ 4.630290434112001e-14 5.76783583488e-15 -4.934703992064001e-14 ] [ -7.04957713152e-15 3.396614436096001e-14 5.04685635552e-14 ] [ -4.197702746496e-14 -7.498186585344001e-14 2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }