{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5841058e-10 2.3786106e-10 3.8886456e-10 ] [ 1.4901821e-10 5.3457164e-10 2.8122136e-10 ] [ 1.0570021e-10 3.109293200000001e-10 2.2294135e-10 ] [ 2.8152807e-10 3.2621432e-10 6.760965e-11 ] [ 3.0211367e-10 4.6137948e-10 4.47347e-10 ] [ 4.3453055e-10 2.5321483e-10 2.338791e-10 ] [ 3.8016246e-10 4.9018965e-10 2.1832597e-10 ] ] "source-value" [ [ 2.5841058 2.3786106 3.8886456 ] [ 1.4901821 5.3457164 2.8122136 ] [ 1.0570021 3.1092932 2.2294135 ] [ 2.8152807 3.2621432 0.6760965 ] [ 3.0211367 4.6137948 4.47347 ] [ 4.3453055 2.5321483 2.338791 ] [ 3.8016246 4.9018965 2.1832597 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.17936221057088e-12 -1.34678966744448e-12 7.61146047243456e-12 ] [ 2.37939249955008e-12 2.5923217724544e-13 -8.562031861555199e-13 ] [ -9.414229606158718e-12 -3.09332240177856e-12 6.9085855888896e-13 ] [ 5.463422276928e-13 2.1933797938752e-13 -8.595998005916159e-12 ] [ -2.1805623809088e-13 3.53087683691904e-12 -2.50564401726912e-12 ] [ 6.236472496464e-12 -2.32187435886336e-12 -4.69485815193024e-12 ] [ 1.64960104877568e-12 2.7525394345344e-12 8.350384329947521e-12 ] ] "source-value" [ [ -0.0007361 -0.0008406 0.0047507 ] [ 0.0014851 0.0001618 -0.0005344 ] [ -0.0058759 -0.0019307 0.0004312 ] [ 0.000341 0.0001369 -0.0053652 ] [ -0.0001361 0.0022038 -0.0015639 ] [ 0.0038925 -0.0014492 -0.0029303 ] [ 0.0010296 0.001718 0.0052119 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.669977170266248e-18 "source-value" -22.906196 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.786277248558175e-09 -3.360817644728115e-09 -8.551701026704281e-10 ] [ -5.604611207718083e-09 8.793900143858673e-09 -1.837584752129468e-09 ] [ -7.6360261659083e-09 -4.878213968114848e-09 -2.025800130222624e-10 ] [ 2.28249702318331e-09 -2.121964693614985e-09 -3.480406030316571e-09 ] [ 2.533794100278914e-09 2.162304296573487e-09 6.127979985062894e-09 ] [ -2.657291636604461e-09 -1.482104858525048e-09 9.613203920695873e-10 ] [ 7.295360638210445e-09 8.868967245508339e-10 -7.13559478993751e-10 ] ] "source-value" [ [ 2.3632084 -2.0976574 -0.5337552 ] [ -3.4981232 5.4887208 -1.1469302 ] [ -4.7660327 -3.0447417 -0.1264405 ] [ 1.4246226 -1.3244262 -2.1722986 ] [ 1.5814699 1.3496042 3.8247843 ] [ -1.658551 -0.9250571 0.600009 ] [ 4.553406 0.5535574 -0.4453688 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.070670668496028e-18 "source-value" -19.165619 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] } "instance-id" 1 }