{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -47.5139788 -56.2946453 67.3388478 ] [ -9.1447308 77.8525581 -86.1512113 ] [ -0.544488 4.4159218 3.0489003 ] [ 16.4239952 -36.574044 -18.235352 ] [ 16.6835928 -12.0814228 28.8874003 ] [ 24.0956098 22.6816321 5.1114149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.612578599454684e-08 -9.01939645758886e-08 1.078887276167695e-07 ] [ -1.465147389126968e-08 1.247335484572937e-07 -1.380294565984608e-07 ] [ -8.723659439061504e-10 7.075086667241053e-09 4.884876779810106e-09 ] [ 2.631414112957142e-08 -5.859807822491051e-08 -2.921625464645852e-08 ] [ 2.673006233510721e-08 -1.935657315616007e-08 4.628271739635091e-08 ] [ 3.860542268547936e-08 3.633998067220682e-08 8.18938945198877e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 39.513657 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.330785744771027e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2473589 0.599139 2.1514823 ] [ 0.2652338 1.9548161 -0.1118293 ] [ 0.1599327 3.1270763 2.2150951 ] [ 1.5966209 -0.2325494 0.3819599 ] [ 2.1002828 -0.0607673 2.9347369 ] [ 2.3879499 2.0635604 1.5329936 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.473589e-11 5.99139e-11 2.1514823e-10 ] [ 2.652338e-11 1.9548161e-10 -1.118293e-11 ] [ 1.599327e-11 3.1270763e-10 2.2150951e-10 ] [ 1.5966209e-10 -2.325494e-11 3.819599000000001e-11 ] [ 2.1002828e-10 -6.076730000000001e-12 2.9347369e-10 ] [ 2.3879499e-10 2.0635604e-10 1.5329936e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 1.86e-05 1.5e-06 ] [ 6.5e-06 -5.9e-06 1.4e-05 ] [ -1.3e-06 -1.59e-05 -9.2e-06 ] [ 3.3e-06 1.46e-05 1.9e-06 ] [ 4e-06 1.19e-05 -1.32e-05 ] [ -1.09e-05 -2.33e-05 5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 2.980048514688e-14 2.4032649312e-15 ] [ 1.04141480352e-14 -9.45284206272e-15 2.24304726912e-14 ] [ -2.08282960704e-15 -2.547460827072e-14 -1.474002491136e-14 ] [ 5.28718284864e-15 2.339177866368e-14 3.04413557952e-15 ] [ 6.4087064832e-15 1.906590178752e-14 -2.114873139456e-14 ] [ -1.746372516672e-14 -3.733071526464e-14 8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.220528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.118162087623178e-18 } }