{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0013371 0.3148345 -0.5715296 ] [ -0.0449253 -0.6585056 -0.1156775 ] [ 0.5365512 0.1740165 0.7299275 ] [ -0.492963 0.1696547 -0.0427205 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.142270377321399e-12 5.044204794770729e-10 -9.156913707593662e-10 ] [ -7.19782659354402e-11 -1.05504228567815e-09 -1.85335787579535e-10 ] [ 8.596497955846607e-10 2.78805170230461e-10 1.169472785014035e-09 ] [ -7.898138000265419e-10 2.718167961882798e-10 -6.8445786892797e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0554320370950805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.130404835260876e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8058818 2.3121877 1.1698173 ] [ 2.3834718 4.4649476 0.5826023 ] [ 2.4579927 4.0064761 3.4988275 ] [ 4.3290997 3.2087176 2.4146966 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8058818e-10 2.3121877e-10 1.1698173e-10 ] [ 2.3834718e-10 4.4649476e-10 5.826023e-11 ] [ 2.4579927e-10 4.006476100000001e-10 3.4988275e-10 ] [ 4.329099700000001e-10 3.2087176e-10 2.4146966e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.04e-05 -6.5e-06 1.2e-05 ] [ 2.14e-05 4.8e-06 -1.21e-05 ] [ -3.29e-05 -6.4e-06 2.28e-05 ] [ 3.2e-05 8e-06 -2.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.26844033336e-14 -1.0414148121e-14 1.9226119608e-14 ] [ 3.42865799676e-14 7.690447843199998e-15 -1.93863372714e-14 ] [ -5.271161125859999e-14 -1.02539304576e-14 3.65296272552e-14 ] [ 5.126965228799999e-14 1.2817413072e-14 -3.636940959179999e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.296414037095081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.329232071622335e-18 } }