{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3243129 0.8928405 -0.3227462 ] [ 1.9206274 -3.3725428 -0.3885886 ] [ -5.7536899 -3.1206868 2.7129398 ] [ -2.9781466 2.426708 -1.9441889 ] [ 6.4868961 3.1736811 -0.0574161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.196065462038484e-10 1.430488175203383e-09 -5.17096416092041e-10 ] [ 3.07718431754789e-09 -5.403409226807371e-09 -6.225875700294029e-10 ] [ -9.21842744111309e-09 -4.999891431799166e-09 4.346608721197828e-09 ] [ -4.77151685583501e-09 3.888014823108326e-09 -3.114934001998869e-09 ] [ 1.03931532729787e-08 5.084797660294827e-09 -9.199073307751489e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -12.066858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933323777411345e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8264195 2.3923147 1.7229703 ] [ 4.8548021 1.7504924 2.8361428 ] [ 3.0402405 2.8118744 4.1648879 ] [ 3.1193379 4.6486514 2.4901552 ] [ 5.147717 4.0068261 3.6033358 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8264195e-10 2.3923147e-10 1.7229703e-10 ] [ 4.8548021e-10 1.7504924e-10 2.8361428e-10 ] [ 3.0402405e-10 2.8118744e-10 4.1648879e-10 ] [ 3.1193379e-10 4.6486514e-10 2.4901552e-10 ] [ 5.147717e-10 4.0068261e-10 3.6033358e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.49e-05 -4.7e-06 -1.82e-05 ] [ 2.9e-06 -1.06e-05 7.5e-06 ] [ -2e-06 4.5e-06 -5.6e-06 ] [ -3e-07 -7.5e-06 1.33e-05 ] [ 1.43e-05 1.83e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.387243164992e-14 -7.53023011776e-15 -2.915961449856e-14 ] [ 4.646312200320001e-15 -1.698307218048e-14 1.2016324656e-14 ] [ -3.2043532416e-15 7.2097947936e-15 -8.972189076479999e-15 ] [ -4.8065298624e-16 -1.2016324656e-14 2.130894905664e-14 ] [ 2.291112567744e-14 2.931983216064e-14 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.9991 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.242903073224128e-18 } }