{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4328351 -17.3759379 -27.0506909 ] [ -6.22383 14.336254 29.9477095 ] [ 0.0033416 0.1795743 0.1482631 ] [ 5.7658902 3.2895826 -6.837615 ] [ 1.8874332 -0.4294731 3.7923333 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.29565489868163e-09 -2.783932146785265e-08 -4.333998453646731e-08 ] [ -9.971674917833665e-09 2.296921098865049e-08 4.798152000741006e-08 ] [ 5.35383339606528e-12 2.877097451565254e-10 2.375436725473325e-10 ] [ 9.237974476539838e-09 5.270492333910478e-09 -1.095506689503139e-08 ] [ 3.024001346361731e-09 -6.880917600825004e-10 6.075987751541312e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0910376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.554564797533743e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3940067 0.398927 0.4570097 ] [ -0.198913 2.0999274 2.0474387 ] [ 2.5499315 0.1795279 1.4954056 ] [ 1.8395048 2.4093437 0.6610787 ] [ 1.957014 1.8805315 3.0858325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.940067e-11 3.98927e-11 4.570097000000001e-11 ] [ -1.98913e-11 2.0999274e-10 2.0474387e-10 ] [ 2.5499315e-10 1.795279e-11 1.4954056e-10 ] [ 1.8395048e-10 2.4093437e-10 6.610787e-11 ] [ 1.957014e-10 1.8805315e-10 3.0858325e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.74e-05 -8.5e-06 -1.07e-05 ] [ -2.62e-05 8.6e-06 7e-06 ] [ 2.34e-05 -1.12e-05 5.2e-06 ] [ 1.2e-05 1.31e-05 -1.7e-05 ] [ 8.2e-06 -1.9e-06 1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.787787320192e-14 -1.36185012768e-14 -1.714328984256e-14 ] [ -4.197702746496e-14 1.377871893888e-14 1.12152363456e-14 ] [ 3.749093292672001e-14 -1.794437815296e-14 8.33131842816e-15 ] [ 1.92261194496e-14 2.098851373248e-14 -2.72370025536e-14 ] [ 1.313784829056e-14 -3.04413557952e-15 2.467351996032e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.997866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.242705364629121e-18 } }