{ "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" [ [ 2.3891594 -11.6709116 -3.741499 ] [ -11.7990993 6.0224827 -3.5647766 ] [ -9.0984572 6.107545 3.8359454 ] [ 12.6501055 -3.0872914 -0.4055044 ] [ 5.8582916 2.6281753 3.8758347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.827855334044556e-09 -1.869886170894352e-08 -5.994542224546579e-09 ] [ -1.890424104495765e-08 9.64908098111246e-09 -5.711401726894914e-09 ] [ -1.457733541118943e-08 9.785365809483935e-09 6.145862038545304e-09 ] [ 2.02677032827535e-08 -4.946386102676901e-09 -6.496896693115315e-10 ] [ 9.386017839349026e-09 4.210801021024026e-09 6.209771742425382e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3442617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.153744667976863e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0390918 -0.2406828 1.4252797 ] [ 0.512978 2.5327114 0.2624728 ] [ 0.0159305 1.6479762 2.3850399 ] [ 2.5314157 1.363106 0.5674474 ] [ 2.2689 2.2246211 2.7408976 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0390918e-10 -2.406828e-11 1.4252797e-10 ] [ 5.129780000000001e-11 2.5327114e-10 2.624728e-11 ] [ 1.59305e-12 1.6479762e-10 2.3850399e-10 ] [ 2.5314157e-10 1.363106e-10 5.674474000000001e-11 ] [ 2.2689e-10 2.2246211e-10 2.7408976e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.19e-05 3.02e-05 3.42e-05 ] [ 6.2e-06 -2.7e-06 4.48e-05 ] [ 6.19e-05 1.97e-05 -7.81e-05 ] [ -7.08e-05 2.5e-06 2.31e-05 ] [ -3.93e-05 -4.97e-05 -2.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.713120041152e-14 4.838573394816e-14 5.479444043136e-14 ] [ 9.93349504896e-15 -4.32587687616e-15 7.177751261183999e-14 ] [ 9.917473282752e-14 3.156287942976e-14 -1.2512999408448e-13 ] [ -1.1343410475264e-13 4.005441552e-15 3.701027994048e-14 ] [ -6.296554119743999e-14 -7.962817805376001e-14 -3.84522388992e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }