{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0333999 -6.2448177 -0.9964042 ] [ -7.81969 4.2184895 -4.8573007 ] [ -6.2877013 2.876271 4.2157495 ] [ 9.4695753 -1.7163042 -3.0447246 ] [ 3.6044161 0.8663614 4.6826801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.655689159717058e-09 -1.000530092009803e-08 -1.596415514106927e-09 ] [ -1.252852449990355e-08 6.758765251990281e-09 -7.782253621735474e-09 ] [ -1.007400802143377e-08 4.608294151285038e-09 6.75437528804929e-09 ] [ 1.517193215456515e-08 -2.749822463420847e-09 -4.878186570894632e-09 ] [ 5.774911207055116e-09 1.388063980243557e-09 7.502480578905406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7704541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.245286650419506e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4733458 -0.081177 1.7214219 ] [ 0.3772859 2.6582291 0.0972982 ] [ -0.0653775 2.6646757 2.4211495 ] [ 2.0922059 1.0791007 -0.3054396 ] [ 1.4908558 1.2069035 3.4467072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4733458e-10 -8.1177e-12 1.7214219e-10 ] [ 3.772859e-11 2.6582291e-10 9.729820000000001e-12 ] [ -6.537750000000001e-12 2.6646757e-10 2.4211495e-10 ] [ 2.0922059e-10 1.0791007e-10 -3.054396e-11 ] [ 1.4908558e-10 1.2069035e-10 3.4467072e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.72e-05 -4.08e-05 2.59e-05 ] [ -2.3e-06 -1.21e-05 3e-05 ] [ -1.6e-06 -2.68e-05 -2.01e-05 ] [ 1.7e-05 4.13e-05 -2.29e-05 ] [ 2.41e-05 3.85e-05 -1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.960097029376001e-14 -6.536880612864e-14 4.149637447872e-14 ] [ -3.68500622784e-15 -1.938633711168e-14 4.8065298624e-14 ] [ -2.56348259328e-15 -4.293833343744e-14 -3.220375007808e-14 ] [ 2.72370025536e-14 6.616989443904001e-14 -3.668984461632e-14 ] [ 3.861245656128e-14 6.16837999008e-14 -2.050786074624e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }