{ "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" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3218197 -7.3838661 -3.4113544 ] [ -3.8926015 5.2393777 -8.1906033 ] [ -10.3571202 1.2709235 12.0924274 ] [ -1.1104149 -2.6436279 -2.6359405 ] [ 5.8464556 -4.6014429 3.4118878 ] [ 6.1918613 8.1186357 -1.2664169 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.32214186185287e-09 -1.183025763653767e-08 -5.465592264943211e-09 ] [ -6.236635117391011e-09 8.394408458480877e-09 -1.312279311750733e-08 ] [ -1.659393584325542e-08 2.036243918525309e-09 1.937420446900133e-08 ] [ -1.77908079216797e-09 -4.2355588154746e-09 -4.223242242919862e-09 ] [ 9.367054476865235e-09 -7.372324236326153e-09 5.466446865952746e-09 ] [ 9.920455414096296e-09 1.300748831133224e-08 -2.029023549366012e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.295237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290349451019513e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5305782 0.2649921 0.1555955 ] [ 0.2391037 2.7403626 -0.0101141 ] [ 0.2663665 1.5869721 2.3049437 ] [ 2.6844792 -0.5084714 0.6342299 ] [ 2.7637491 1.1397107 2.2906585 ] [ 1.9695459 3.4181515 1.6442752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.305782e-11 2.649921e-11 1.555955e-11 ] [ 2.391037e-11 2.7403626e-10 -1.01141e-12 ] [ 2.663665e-11 1.5869721e-10 2.3049437e-10 ] [ 2.6844792e-10 -5.084714e-11 6.342299e-11 ] [ 2.7637491e-10 1.1397107e-10 2.2906585e-10 ] [ 1.9695459e-10 3.4181515e-10 1.6442752e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.15e-05 1.44e-05 4.88e-05 ] [ 2.98e-05 -8.05e-05 0.0001601 ] [ 0.0001445 7.34e-05 -0.0001886 ] [ -5.77e-05 -6.61e-05 -8.65e-05 ] [ -0.0001062 9.46e-05 5.91e-05 ] [ -6.19e-05 -3.58e-05 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.25120959712e-14 2.307134333952e-14 7.818621909504e-14 ] [ 4.774486329984001e-14 -1.289752179744e-13 2.5650847699008e-13 ] [ 2.315145217056e-13 1.1759976396672e-13 -3.0217051068288e-13 ] [ -9.244559102016e-14 -1.0590387463488e-13 -1.385882776992e-13 ] [ -1.7015115712896e-13 1.5156590832768e-13 9.468863828927999e-14 ] [ -9.917473282752e-14 -5.735792302464001e-14 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.311101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.25419711649075e-18 } }