{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.8801608 15.081374 -69.9625092 ] [ -28.99624 -33.6050464 71.5636292 ] [ 0.2180626 10.8849073 -85.2087702 ] [ 89.8698158 -21.7949334 53.5046957 ] [ -76.9717993 29.4336985 30.1029545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.544282257792275e-08 2.416302503141511e-08 -1.1209229749625e-07 ] [ -4.645709820185616e-08 -5.384122012656581e-08 1.146575745484801e-07 ] [ 3.493748024692883e-10 1.743954413931603e-08 -1.365195006263155e-07 ] [ 1.43987318976644e-07 -3.491933303306617e-08 8.572397325982026e-08 ] [ -1.233224183153975e-07 4.715798398890084e-08 4.823025031426515e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 53.449988 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.563632186118039e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6450699 0.5898209 1.3003045 ] [ -0.1109846 0.754795 2.9012657 ] [ 2.0358 2.8416671 0.3554158 ] [ 3.5345974 1.9771678 2.0884944 ] [ 1.2486661 2.6998078 2.6956286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6450699e-10 5.898209e-11 1.3003045e-10 ] [ -1.109846e-11 7.54795e-11 2.9012657e-10 ] [ 2.0358e-10 2.8416671e-10 3.554158e-11 ] [ 3.5345974e-10 1.9771678e-10 2.0884944e-10 ] [ 1.2486661e-10 2.6998078e-10 2.6956286e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.17e-05 -1.6e-05 -3.9e-06 ] [ -1.45e-05 -1.67e-05 3.2e-06 ] [ 1.08e-05 1e-06 6.8e-06 ] [ 1.1e-06 1.59e-05 -5.3e-06 ] [ 1.42e-05 1.57e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.87454666178e-14 -2.5634826144e-14 -6.248488872599999e-15 ] [ -2.3231561193e-14 -2.67563497878e-14 5.1269652288e-15 ] [ 1.73035076472e-14 1.602176634e-15 1.08948011112e-14 ] [ 1.7623942974e-15 2.54746084806e-14 -8.4915361602e-15 ] [ 2.27509082028e-14 2.515417315379999e-14 -1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.106836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.260164301887002e-18 } }