{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3047527 -1.9067954 0.7011968 ] [ -5.7422497 -2.8630753 3.7698131 ] [ -1.1190772 1.1345935 -0.4409982 ] [ 4.9153958 1.6568147 -7.9906429 ] [ 0.130444 -6.5168665 5.8557128 ] [ -1.9285229 6.7113195 -2.6585717 ] [ 4.0487627 1.7840096 0.7634902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.882676550884118e-10 -3.055023035698684e-09 1.123441128795571e-09 ] [ -9.200098295933509e-09 -4.58715234704254e-09 6.039906463367104e-09 ] [ -1.792959341482144e-09 1.817819194788279e-09 -7.065570116760588e-10 ] [ 7.875332297621736e-09 2.654509799207719e-09 -1.2802421345018e-08 ] [ 2.08994328845496e-10 -1.044117123319736e-08 9.381886223574715e-09 ] [ -3.089834328513918e-09 1.075271928620856e-08 -4.259501457553658e-09 ] [ 6.486832994550751e-09 2.858298495951686e-09 1.223246158727987e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.336695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.777644763978463e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6091607 1.0956495 1.831861 ] [ 1.6538673 2.3240683 3.8867657 ] [ 1.2068581 3.195412 1.6944031 ] [ 4.6777531 2.5765293 1.5369693 ] [ 4.0409327 1.8393994 3.8469951 ] [ 3.066306 4.3347825 3.1241208 ] [ 5.4506301 3.8332761 3.486986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6091607e-10 1.0956495e-10 1.831861e-10 ] [ 1.6538673e-10 2.3240683e-10 3.8867657e-10 ] [ 1.2068581e-10 3.195412e-10 1.6944031e-10 ] [ 4.6777531e-10 2.5765293e-10 1.5369693e-10 ] [ 4.0409327e-10 1.8393994e-10 3.8469951e-10 ] [ 3.066306e-10 4.3347825e-10 3.1241208e-10 ] [ 5.450630099999999e-10 3.8332761e-10 3.486986e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.64e-05 -9.67e-05 -6.33e-05 ] [ 5.52e-05 -1.98e-05 3.3e-05 ] [ -2.23e-05 2.12e-05 -2.54e-05 ] [ -1.28e-05 -4.55e-05 -6.38e-05 ] [ -9.9e-06 -4.2e-05 3.27e-05 ] [ 2.58e-05 9.25e-05 -9e-07 ] [ 2.04e-05 9.04e-05 8.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.03627621576e-14 -1.549304805078e-13 -1.014177809322e-13 ] [ 8.844015019679999e-14 -3.17230973532e-14 5.287182892199999e-14 ] [ -3.572853893819999e-14 3.39661446408e-14 -4.06952865036e-14 ] [ -2.05078609152e-14 -7.289903684699999e-14 -1.022188692492e-13 ] [ -1.58615486766e-14 -6.729141862799998e-14 5.23911759318e-14 ] [ 4.133615715719999e-14 1.48201338645e-13 -1.4419589706e-15 ] [ 3.26844033336e-14 1.448367677136e-13 1.405108908018e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.361861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.422547455295587e-18 } }