{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8841519 -6.4269392 -6.3898517 ] [ -11.6380571 -1.7513582 1.8014994 ] [ -0.4614636 1.7068541 -0.1709934 ] [ 2.2747259 0.4837514 7.8153265 ] [ 7.9406429 5.987692 -3.0559808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.018744149086704e-09 -1.029709181437865e-08 -1.023767108846518e-08 ] [ -1.86462231507778e-08 -2.805985185804299e-09 2.886320244845019e-09 ] [ -7.393461973615223e-10 2.734681756667099e-09 -2.739616300482156e-10 ] [ 3.64451268573462e-09 7.750551897447875e-10 1.2521533505381e-08 ] [ 1.2722312513318e-08 9.593340213988727e-09 -4.896221031712626e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5173608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.839786555107547e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0529061 0.7257406 1.6333539 ] [ 1.2181644 1.7010332 3.1802749 ] [ 1.6601949 3.9760819 2.0230554 ] [ 3.1325539 2.325938 4.8097062 ] [ 4.0122606 2.9841544 2.4637955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0529061e-10 7.257405999999999e-11 1.6333539e-10 ] [ 1.2181644e-10 1.7010332e-10 3.1802749e-10 ] [ 1.6601949e-10 3.9760819e-10 2.0230554e-10 ] [ 3.1325539e-10 2.325938e-10 4.8097062e-10 ] [ 4.0122606e-10 2.9841544e-10 2.4637955e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.4e-06 -5e-06 -1.52e-05 ] [ 1.86e-05 -2.7e-06 8e-07 ] [ -9.4e-06 3.7e-06 -1e-07 ] [ -9.9e-06 1.05e-05 1.18e-05 ] [ 1.01e-05 -6.4e-06 2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.50604603596e-14 -8.010883169999999e-15 -2.43530848368e-14 ] [ 2.98004853924e-14 -4.3258769118e-15 1.2817413072e-15 ] [ -1.50604603596e-14 5.9280535458e-15 -1.602176634e-16 ] [ -1.58615486766e-14 1.6822854657e-14 1.89056842812e-14 ] [ 1.61819840034e-14 -1.02539304576e-14 4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658097671503e-18 } }