{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8439324 -6.4488744 1.2128038 ] [ -5.5824402 7.5771159 0.9803952 ] [ 6.4841561 -2.702319 -1.58159 ] [ -5.6449776 -5.5350379 -8.3848778 ] [ 3.465698 -5.5464184 2.1694823 ] [ 3.2462655 9.8179094 -3.2486883 ] [ 6.8752306 2.8376244 8.8524748 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.416954172721564e-08 -1.033223579415563e-08 1.943125893977399e-09 ] [ -8.944055175454077e-09 1.213987794807195e-08 1.57076626858454e-09 ] [ 1.038876330903771e-08 -4.329592323743636e-09 -2.533986521691072e-09 ] [ -9.044251135659694e-09 -8.868108318621929e-09 -1.343405517942494e-08 ] [ 5.552660310353319e-09 -8.886341889654944e-09 3.475893820299412e-09 ] [ 5.201090689009622e-09 1.573002490581255e-08 -5.204972442526497e-09 ] [ 1.101533372992876e-08 4.546375472291628e-09 1.418322816078116e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3319172 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.133966598681398e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5417843 2.4252615 2.7912609 ] [ 3.1862905 4.7668627 3.2794917 ] [ 5.5376051 2.7987481 1.2754094 ] [ 3.3384431 2.0870481 0.5204698 ] [ 4.9923155 1.9227418 3.5275442 ] [ 4.8401698 5.0762336 1.5683121 ] [ 4.8137647 3.9325143 4.881984 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5417843e-10 2.4252615e-10 2.7912609e-10 ] [ 3.1862905e-10 4.7668627e-10 3.2794917e-10 ] [ 5.537605100000001e-10 2.7987481e-10 1.2754094e-10 ] [ 3.3384431e-10 2.0870481e-10 5.204698e-11 ] [ 4.9923155e-10 1.9227418e-10 3.5275442e-10 ] [ 4.8401698e-10 5.0762336e-10 1.5683121e-10 ] [ 4.8137647e-10 3.9325143e-10 4.881984e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.08e-05 -5.4e-06 4.98e-05 ] [ 8.7e-06 -4.09e-05 -5.5e-06 ] [ 3.16e-05 -2.98e-05 -3.79e-05 ] [ -6.2e-06 2.7e-06 -2.99e-05 ] [ -6.4e-06 3.83e-05 2.05e-05 ] [ 1.66e-05 3.6e-05 2.11e-05 ] [ -1.36e-05 -8e-07 -1.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.934703992064001e-14 -8.65175375232e-15 7.978839571583999e-14 ] [ 1.393893660096e-14 -6.552902379072e-14 -8.8119714144e-15 ] [ 5.062878121728e-14 -4.774486329984001e-14 -6.072249392832e-14 ] [ -9.93349504896e-15 4.32587687616e-15 -4.790508096192e-14 ] [ -1.025393037312e-14 6.136336457664001e-14 3.28446207264e-14 ] [ 2.659613190528e-14 5.76783583488e-14 3.380592669888e-14 ] [ -2.178960204288e-14 -1.28174129664e-15 -2.88391791744e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }