{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -49.4265187 9.394115 -32.2745067 ] [ 7.3997719 -14.6759568 6.2689517 ] [ 39.0484661 -5.8266242 21.74483 ] [ -32.9726373 20.4268646 25.5657273 ] [ 33.3046431 -58.0240555 -113.4240457 ] [ 9.1879006 35.7747864 35.6878947 ] [ -6.5416257 12.9308705 56.4311487 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.919001336110405e-08 1.505103155010891e-08 -5.170946050861645e-08 ] [ 1.185574163510978e-08 -2.351347506655341e-08 1.004396793341458e-08 ] [ 6.256253997896109e-08 -9.335281148338942e-09 3.483905853630222e-08 ] [ -5.282798904341685e-08 3.272744516800175e-08 4.09608109112759e-08 ] [ 5.335992097852932e-08 -9.296478593201918e-08 -1.817253557542882e-07 ] [ 1.472063965683458e-08 5.731752685642098e-08 5.717831100499244e-08 ] [ -1.048083984491389e-08 2.071753857237989e-08 9.041266787691946e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.722729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.402976843851418e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2884249 3.1667692 2.1235165 ] [ 2.6461628 1.6840934 1.6347856 ] [ 2.2133717 2.1371541 4.3618838 ] [ 1.3371442 5.0038011 3.9796623 ] [ 4.5686814 3.5663228 1.5729457 ] [ 3.1561326 5.9665761 2.0634255 ] [ 4.2252431 4.0736733 4.3071228 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.884249e-11 3.1667692e-10 2.1235165e-10 ] [ 2.6461628e-10 1.6840934e-10 1.6347856e-10 ] [ 2.2133717e-10 2.1371541e-10 4.3618838e-10 ] [ 1.3371442e-10 5.0038011e-10 3.9796623e-10 ] [ 4.5686814e-10 3.5663228e-10 1.5729457e-10 ] [ 3.1561326e-10 5.9665761e-10 2.0634255e-10 ] [ 4.2252431e-10 4.073673300000001e-10 4.3071228e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.86e-05 1.63e-05 1.01e-05 ] [ 4.56e-05 -1.73e-05 2e-06 ] [ -3.64e-05 8.4e-05 -4.7e-06 ] [ -6.77e-05 -4.7e-05 1.86e-05 ] [ -6.19e-05 1.98e-05 3.6e-06 ] [ 2.24e-05 -4e-07 -1.75e-05 ] [ 5.94e-05 -5.54e-05 -1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.18440180724e-14 2.61154791342e-14 1.61819840034e-14 ] [ 7.30592545104e-14 -2.77176557682e-14 3.204353268e-15 ] [ -5.831922947759999e-14 1.34582837256e-13 -7.530230179799999e-15 ] [ -1.084673581218e-13 -7.530230179799998e-14 2.98004853924e-14 ] [ -9.917473364459999e-14 3.17230973532e-14 5.767835882399999e-15 ] [ 3.588875660159999e-14 -6.408706536e-16 -2.8038091095e-14 ] [ 9.51692920596e-14 -8.876058552359998e-14 -1.93863372714e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.040917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.050691230733338e-18 } }