{ "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" [ [ 1.480644 1.446872 2.305559 ] [ 2.063952 3.613106 1.277693 ] [ 1.847715 3.513174 3.941338 ] [ 3.676983 1.999062 1.431631 ] [ 3.525184 1.303022 4.049537 ] [ 4.005288 3.245475 3.233925 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.480644e-10 1.446872e-10 2.305559e-10 ] [ 2.063952e-10 3.613106000000001e-10 1.277693e-10 ] [ 1.847715e-10 3.513174e-10 3.941338e-10 ] [ 3.676983e-10 1.999062e-10 1.431631e-10 ] [ 3.525184e-10 1.303022e-10 4.049537e-10 ] [ 4.005288e-10 3.245475e-10 3.233925e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7791935 2.784603 -2.2858208 ] [ 3.6381444 -6.4678973 1.020379 ] [ 4.4677105 -0.0146527 -1.2918131 ] [ -7.6840511 3.0477439 -0.9711436 ] [ -0.1712075 -2.2683335 1.3574768 ] [ -4.0297898 2.9185366 2.1709217 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.054935471179325e-09 4.461425824809542e-09 -3.662288645098353e-09 ] [ 5.828949900774444e-09 -1.036271383979544e-08 1.634827378155283e-09 ] [ 7.158061311602678e-09 -2.347621337159616e-11 -2.069712747263172e-09 ] [ -1.231120702545252e-08 4.883024022765814e-09 -1.555943571359547e-09 ] [ -2.74304653805616e-10 -3.634270901877437e-09 2.174917592238397e-09 ] [ -6.456435004298307e-09 4.676011107469121e-09 3.478199993327392e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8115615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.091332458644138e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9336144 1.9586821 0.8881648 ] [ 1.0553775 3.7559731 1.8081928 ] [ 1.9796654 4.4439619 3.6869783 ] [ 3.7439058 0.7347633 1.1428392 ] [ 4.3706614 1.1152466 4.1729808 ] [ 3.5165415 3.1120841 4.5405271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9336144e-10 1.9586821e-10 8.881648000000001e-11 ] [ 1.0553775e-10 3.7559731e-10 1.8081928e-10 ] [ 1.9796654e-10 4.4439619e-10 3.6869783e-10 ] [ 3.7439058e-10 7.347633e-11 1.1428392e-10 ] [ 4.3706614e-10 1.1152466e-10 4.172980800000001e-10 ] [ 3.516541500000001e-10 3.1120841e-10 4.5405271e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0872947 -0.0257636 -0.2234086 ] [ -0.0785122 0.1555132 0.0460918 ] [ 0.2100866 -0.2184871 0.1500783 ] [ 0.0650161 -0.1962736 -0.1229279 ] [ -0.0109974 0.2905188 0.1821441 ] [ -0.0982984 -0.0055077 -0.0319777 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.398615274597498e-10 -4.127783758764288e-11 -3.579400358056589e-10 ] [ -1.257904112875738e-10 2.491596132657945e-10 7.384720437058945e-11 ] [ 3.365958388633613e-10 -3.500549235663917e-10 2.404519435494086e-10 ] [ 1.041672753955949e-10 -3.144649732002509e-10 -1.969522074240403e-10 ] [ -1.761977716958592e-11 4.654624292628711e-10 2.918270186366573e-10 ] [ -1.574913983420467e-10 -8.82430817438016e-12 -5.123392332695616e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.107627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.100073353356685e-18 } }