{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 282.3982528 235.639058 -93.6443135 ] [ -483.5467132 270.9915584 400.5334384 ] [ 361.4374115 -282.2284131 11.7771322 ] [ -113.7109977 -272.4538269 -789.8094305 ] [ -46.5779535 48.0516237 471.1431735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.524518783909282e-07 3.775353896749353e-07 -1.500347297605658e-07 ] [ -7.747272389537228e-07 4.341763393026378e-07 6.41725310853117e-07 ] [ 5.790865705877691e-07 -4.521797651943045e-07 1.886904587091087e-08 ] [ -1.821851020427826e-07 -4.365191517066702e-07 -1.265414204434463e-06 ] [ -7.462610814240954e-08 7.698718808361919e-08 7.548545776312181e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 302.33462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.843934598224521e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.019392 0.6198926 0.4422076 ] [ -0.6642682 1.5736004 3.1287257 ] [ 2.1559452 -0.0221355 2.5455328 ] [ 2.23247 2.4829298 0.4103785 ] [ 1.8975065 2.9734331 3.2721979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.9392e-12 6.198926000000001e-11 4.422076e-11 ] [ -6.642682e-11 1.5736004e-10 3.1287257e-10 ] [ 2.1559452e-10 -2.21355e-12 2.5455328e-10 ] [ 2.23247e-10 2.4829298e-10 4.103785e-11 ] [ 1.8975065e-10 2.9734331e-10 3.2721979e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-06 8.3e-06 2e-06 ] [ 2e-07 -2.6e-06 3.6e-06 ] [ 4e-06 -5e-06 -1e-06 ] [ 4.7e-06 -4.2e-06 9e-07 ] [ -7.7e-06 3.6e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92261194496e-15 1.329806595264e-14 3.2043532416e-15 ] [ 3.2043532416e-16 -4.16565921408e-15 5.76783583488e-15 ] [ 6.4087064832e-15 -8.010883104e-15 -1.6021766208e-15 ] [ 7.53023011776e-15 -6.72914180736e-15 1.44195895872e-15 ] [ -1.233675998016e-14 5.76783583488e-15 -8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689399964722e-18 } }