{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.1590854 -36.5706042 -28.0878128 ] [ -41.3079485 21.0488706 31.7912891 ] [ -17.8127408 -7.3815287 -101.3832455 ] [ 58.0445227 -60.0481322 41.226137 ] [ 23.235252 82.9513945 56.4536322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.550276856619061e-08 -5.859256705777029e-08 -4.500163699756698e-08 ] [ -6.618262933991044e-08 3.372400836956447e-08 5.093526014111387e-08 ] [ -2.853915686213029e-08 -1.182651270890422e-08 -1.624338656809268e-07 ] [ 9.29975772354349e-08 -9.620771353354766e-08 6.605155286729786e-08 ] [ 3.722697753279644e-08 1.329027849306577e-07 9.044868967008208e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.604826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.781910035525198e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3327724 0.8036598 0.7281127 ] [ 2.207607 2.2274417 2.9190438 ] [ 4.0972654 2.4674992 -0.2522986 ] [ 4.646122 1.2383545 2.1394323 ] [ 3.9721352 3.8912501 1.9386503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3327724e-10 8.036598000000001e-11 7.281127e-11 ] [ 2.207607e-10 2.2274417e-10 2.9190438e-10 ] [ 4.0972654e-10 2.4674992e-10 -2.522986e-11 ] [ 4.646122e-10 1.2383545e-10 2.1394323e-10 ] [ 3.9721352e-10 3.8912501e-10 1.9386503e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 2.85e-05 2.5e-06 ] [ 2.78e-05 -1.02e-05 -2.34e-05 ] [ -1e-05 -1.81e-05 -1.4e-06 ] [ -9.5e-06 2.81e-05 1.22e-05 ] [ -1e-05 -2.83e-05 1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 4.56620336928e-14 4.005441552e-15 ] [ 4.454051005824e-14 -1.634220153216e-14 -3.749093292672001e-14 ] [ -1.6021766208e-14 -2.899939683648e-14 -2.24304726912e-15 ] [ -1.52206778976e-14 4.502116304448e-14 1.954655477376e-14 ] [ -1.6021766208e-14 -4.534159836864e-14 1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.806069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.692629083935164e-18 } }