{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2934362 2.840867 1.110891 ] [ 0.7634727 2.370483 2.358735 ] [ 2.954483 0.5132865 0.5514058 ] [ 1.977096 2.170821 0.0967804 ] [ 2.774594 2.595093 2.624283 ] [ 2.05175 1.547661 1.964386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.934362e-11 2.840867e-10 1.110891e-10 ] [ 7.634727e-11 2.370483e-10 2.358735e-10 ] [ 2.954483e-10 5.132865e-11 5.514058e-11 ] [ 1.977096e-10 2.170821e-10 9.67804e-12 ] [ 2.774594e-10 2.595093e-10 2.624283e-10 ] [ 2.05175e-10 1.547661e-10 1.964386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -32.9557701 29.4468412 -65.6766177 ] [ -31.9356327 3.6069309 86.4172256 ] [ 19.1367962 -21.3983334 -11.7949884 ] [ 0.5155711 10.6201834 -18.9157447 ] [ 48.8216927 54.370607 34.3547534 ] [ -3.5826572 -76.646229 -24.3846283 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.280096480969584e-08 4.717904091574852e-08 -1.052255422790908e-07 ] [ -5.116652450394633e-08 5.778940408432589e-09 1.384556596314266e-07 ] [ 3.066052772125999e-08 -3.428390978002177e-08 -1.889765481278104e-08 ] [ 8.260359695856772e-10 1.701540969227467e-08 -3.030636417304934e-08 ] [ 7.822097527626836e-08 8.711131611179683e-08 5.504238316431205e-08 ] [ -5.740049653471864e-09 -1.228007971880132e-07 -3.906848169103513e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 49.170687 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.878012578912755e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0467773 2.4420512 0.7458262 ] [ 0.5528226 2.8598319 3.126194 ] [ 3.0465445 0.2377157 0.0451553 ] [ 2.5162513 2.5563892 0.1988379 ] [ 2.9728187 2.9848835 2.6521071 ] [ 1.6796174 0.95734 1.9383607 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.67773e-12 2.4420512e-10 7.458262e-11 ] [ 5.528226000000001e-11 2.8598319e-10 3.126194e-10 ] [ 3.0465445e-10 2.377157e-11 4.515530000000001e-12 ] [ 2.5162513e-10 2.5563892e-10 1.988379e-11 ] [ 2.9728187e-10 2.9848835e-10 2.6521071e-10 ] [ 1.6796174e-10 9.5734e-11 1.9383607e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001497 4.13e-05 -0.0001271 ] [ -6.82e-05 -4.99e-05 0.0001283 ] [ -3.38e-05 2.16e-05 3.08e-05 ] [ 7.35e-05 -8.22e-05 -5.45e-05 ] [ 0.0001052 4.15e-05 3.82e-05 ] [ 7.3e-05 2.79e-05 -1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.398458421098e-13 6.61698949842e-14 -2.036366501814e-13 ] [ -1.092684464388e-13 -7.994861403659999e-14 2.055592621422e-13 ] [ -5.415357022919999e-14 3.46070152944e-14 4.93470403272e-14 ] [ 1.17759982599e-13 -1.316989193148e-13 -8.7318626553e-14 ] [ 1.685489818968e-13 6.649033031099999e-14 6.12031474188e-14 ] [ 1.16958894282e-13 4.470072808859999e-14 -2.49939554904e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.517052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806541141096297e-18 } }