{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1566212 0.5831265 -0.8475485 ] [ 1.1219464 0.0986237 -0.2276371 ] [ -0.5472813 -0.4504506 0.4949074 ] [ -1.7312864 -0.2312996 0.5802783 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.853111461029041e-09 9.342716529662008e-10 -1.357922402881749e-09 ] [ 1.797556306680417e-09 1.580125876986258e-10 -3.647148426515214e-10 ] [ -8.76841311085144e-10 -7.217014260912803e-10 7.929290722736915e-10 ] [ -2.773826616841977e-09 -3.705828145735464e-10 9.297083334772421e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.40763234615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.347051209226692e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4764613 2.4415008 2.5783357 ] [ 2.1256931 4.482552 3.3334899 ] [ 3.3275239 2.3379933 1.2666581 ] [ 3.9760678 4.379639 2.0207963 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4764613e-10 2.4415008e-10 2.5783357e-10 ] [ 2.1256931e-10 4.482552e-10 3.3334899e-10 ] [ 3.3275239e-10 2.3379933e-10 1.2666581e-10 ] [ 3.9760678e-10 4.379639e-10 2.0207963e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.16e-05 5e-06 1.82e-05 ] [ -2.4e-06 -2.72e-05 -4.42e-05 ] [ -2.35e-05 4.94e-05 1.49e-05 ] [ 4.4e-06 -2.72e-05 1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.46070152944e-14 8.010883169999999e-15 2.915961473879999e-14 ] [ -3.845223921599999e-15 -4.35792044448e-14 -7.08162072228e-14 ] [ -3.765115089899999e-14 7.91475257196e-14 2.38724318466e-14 ] [ 7.0495771896e-15 -4.35792044448e-14 1.77841606374e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }