{ "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" [ [ -6.6477707 -9.4845531 -5.0440132 ] [ -15.2962552 2.1606628 12.9626953 ] [ 3.6348747 5.3933639 -20.0906579 ] [ 13.4960415 -10.7752485 8.0450358 ] [ 4.8131096 12.7057749 4.1269401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.065090279597925e-08 -1.519592923555616e-08 -8.081400024046595e-09 ] [ -2.450730246723043e-08 3.461763423592267e-09 2.076852735221404e-08 ] [ 5.823711263877414e-09 8.641121548046708e-09 -3.218878238387083e-08 ] [ 2.162304216464656e-08 -1.726385123001027e-08 1.288956827225903e-08 ] [ 7.71145167446804e-09 2.035689549392746e-08 6.612086943662013e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.6672438 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.548863200393375e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7218328 0.7325061 0.9403486 ] [ 1.872644 2.5348911 2.543154 ] [ 3.5995215 2.7726616 -0.3269803 ] [ 4.8813838 1.0693644 2.2675959 ] [ 4.18052 3.5187822 2.0488223 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7218328e-10 7.325061000000001e-11 9.403486e-11 ] [ 1.872644e-10 2.5348911e-10 2.543154e-10 ] [ 3.5995215e-10 2.7726616e-10 -3.269803e-11 ] [ 4.881383800000001e-10 1.0693644e-10 2.2675959e-10 ] [ 4.18052e-10 3.5187822e-10 2.0488223e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.72e-05 -4.31e-05 -1.22e-05 ] [ -2.28e-05 1.3e-05 -4e-06 ] [ -1.48e-05 1.51e-05 -1.95e-05 ] [ 2.96e-05 -2.16e-05 1.58e-05 ] [ 2.52e-05 3.66e-05 1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.755743787776e-14 -6.905381235648e-14 -1.954655477376e-14 ] [ -3.652962695424e-14 2.08282960704e-14 -6.4087064832e-15 ] [ -2.371221398784e-14 2.419286697408e-14 -3.12424441056e-14 ] [ 4.742442797568e-14 -3.460701500928e-14 2.531439060864e-14 ] [ 4.037485084416e-14 5.863966432128e-14 3.172309709184e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }