{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.464406 -1.0288981 -1.2588897 ] [ -1.6042221 -0.175169 0.8741759 ] [ -2.5193443 -0.5306946 -0.8212989 ] [ 0.9038104 3.0672747 0.5335875 ] [ 0.4467319 -0.6980984 -2.7132613 ] [ 2.817879 -1.5112803 2.944305 ] [ 1.4195511 0.8768657 0.4413816 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.346237056559245e-09 -1.64847648100554e-09 -2.016963645505926e-09 ] [ -2.57024714319068e-09 -2.806516764889152e-10 1.400584189446799e-09 ] [ -4.036434537205742e-09 -8.502664809048077e-10 -1.315865896268757e-09 ] [ 1.448063892515897e-09 4.914315813911334e-09 8.5490141765112e-10 ] [ 7.157434059455635e-10 -1.118476935497887e-09 -4.347123820981415e-09 ] [ 4.514739854043283e-09 -2.42133796413561e-09 4.717296635504544e-09 ] [ 2.274371584450923e-09 1.404893724121426e-09 7.071712803712972e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.653002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.911152316173564e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1519353 1.1213852 2.9159246 ] [ 1.7859484 2.6491739 4.536096 ] [ 2.0552707 3.579719 2.1476472 ] [ 3.297115 4.3065412 4.2860009 ] [ 3.8893557 1.8344809 1.6645656 ] [ 4.2333171 1.9061236 4.2179086 ] [ 4.5971107 3.8030183 2.5113143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1519353e-10 1.1213852e-10 2.9159246e-10 ] [ 1.7859484e-10 2.6491739e-10 4.536096e-10 ] [ 2.0552707e-10 3.579719e-10 2.1476472e-10 ] [ 3.297115e-10 4.3065412e-10 4.2860009e-10 ] [ 3.8893557e-10 1.8344809e-10 1.6645656e-10 ] [ 4.2333171e-10 1.9061236e-10 4.217908600000001e-10 ] [ 4.5971107e-10 3.803018300000001e-10 2.5113143e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.86e-05 2.36e-05 1.94e-05 ] [ -6.4e-06 1.14e-05 -2.56e-05 ] [ 1.33e-05 -2.21e-05 2.51e-05 ] [ 1.7e-06 -3.29e-05 -9.1e-06 ] [ -7.6e-06 1.94e-05 -1.28e-05 ] [ -1.4e-05 -4.3e-06 1.79e-05 ] [ -5.6e-06 4.9e-06 -1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.980048514688e-14 3.781136825088e-14 3.108222644352e-14 ] [ -1.025393037312e-14 1.826481347712e-14 -4.101572149248001e-14 ] [ 2.130894905664e-14 -3.540810331968e-14 4.021463318208e-14 ] [ 2.72370025536e-15 -5.271161082432e-14 -1.457980724928e-14 ] [ -1.217654231808e-14 3.108222644352e-14 -2.050786074624e-14 ] [ -2.24304726912e-14 -6.889359469440001e-15 2.867896151232001e-14 ] [ -8.972189076479999e-15 7.850665441919999e-15 -2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }