{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.805830000000001e-11 6.363244e-11 1.1242003e-10 ] [ 2.7500952e-10 4.81775e-11 2.395452e-10 ] [ 2.334656e-10 2.4155295e-10 9.772219e-11 ] ] "source-value" [ [ 0.680583 0.6363244 1.1242003 ] [ 2.7500952 0.481775 2.395452 ] [ 2.334656 2.4155295 0.9772219 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.6499097870784e-13 -1.3666566575424e-13 -4.6527209068032e-13 ] [ 7.3411732765056e-13 1.72233986736e-13 3.1210400573184e-13 ] [ 2.3103386871936e-13 -3.556832098176e-14 1.5316808494848e-13 ] ] "source-value" [ [ -0.0006023 -8.53e-05 -0.0002904 ] [ 0.0004582 0.0001075 0.0001948 ] [ 0.0001442 -2.22e-05 9.56e-05 ] ] } "species" { "source-value" [ "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" -1.207298098588239e-18 "source-value" -7.5353621 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.378716681282705e-09 -3.99989481653879e-10 2.165727186706165e-09 ] [ -4.342773911455943e-09 4.737782866866404e-09 -5.365375796876847e-09 ] [ 9.640572301732376e-10 -4.337793385212524e-09 3.199648770388345e-09 ] ] "source-value" [ [ 2.1088291 -0.2496538 1.3517406 ] [ -2.7105463 2.9570915 -3.3488042 ] [ 0.6017172 -2.7074377 1.9970637 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.107778256916599e-18 "source-value" -6.9142081 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.176072000000001e-11 7.140121000000001e-11 1.097767e-10 ] [ 2.809034e-10 3.429818e-11 2.513803e-10 ] [ 2.238693e-10 2.476635e-10 8.853041000000001e-11 ] ] "source-value" [ [ 0.7176072 0.7140121 1.097767 ] [ 2.809034 0.3429818 2.513803 ] [ 2.238693 2.476635 0.8853041 ] ] } "instance-id" 1 }