{ "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" [ [ 0.8784497 0.4697805 1.02237 ] [ 0.3714623 2.027429 0.7033507 ] [ 0.1687176 1.823848 2.813644 ] [ 2.523837 0.1233038 2.780688 ] [ 2.720424 2.179791 0.2128499 ] [ 1.955613 2.373981 2.741889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.784497e-11 4.697805e-11 1.02237e-10 ] [ 3.714623e-11 2.027429e-10 7.033507e-11 ] [ 1.687176e-11 1.823848e-10 2.813644e-10 ] [ 2.523837e-10 1.233038e-11 2.780688e-10 ] [ 2.720424e-10 2.179791e-10 2.128499e-11 ] [ 1.955613e-10 2.373981e-10 2.741889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.4327961 -20.4284857 1.4797715 ] [ -3.9488778 18.7973127 -7.4359389 ] [ -10.7985565 -2.2304154 7.9663747 ] [ -0.0035613 0.135793 0.2260006 ] [ 0.8499233 0.6763117 -0.3861979 ] [ 8.4682762 3.0494836 -1.8500099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.704298968706327e-09 -3.273004245654313e-08 2.37085532095913e-09 ] [ -6.326799741681324e-09 3.011661518993145e-08 -1.191368755743166e-08 ] [ -1.730119490522882e-08 -3.573519437993763e-09 1.276353940202876e-08 ] [ -5.705831646664199e-12 2.17564371660762e-10 3.620928805899804e-10 ] [ 1.361727251952172e-09 1.083570803040818e-09 -6.187572514798685e-10 ] [ 1.356767425789831e-08 4.885811369686202e-09 -2.964042634448677e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.483460055642622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198982484262295e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7291566 0.0153466 1.1501988 ] [ 0.336254 2.2892642 0.4744737 ] [ 0.0210889 1.7191503 2.7848966 ] [ 2.5906827 0.2004727 2.5698732 ] [ 2.6696978 2.1768943 0.4885187 ] [ 2.2716235 2.5970052 2.8068306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.291566000000001e-11 1.53466e-12 1.1501988e-10 ] [ 3.36254e-11 2.2892642e-10 4.744737e-11 ] [ 2.10889e-12 1.7191503e-10 2.7848966e-10 ] [ 2.5906827e-10 2.004727e-11 2.5698732e-10 ] [ 2.6696978e-10 2.1768943e-10 4.885187e-11 ] [ 2.2716235e-10 2.5970052e-10 2.8068306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.72e-05 -2.59e-05 1.11e-05 ] [ -2.23e-05 -1.14e-05 -7.3e-06 ] [ -1.74e-05 -1e-05 1.59e-05 ] [ 1.77e-05 -2.05e-05 -9.4e-06 ] [ 8.96e-05 2.94e-05 -5.84e-05 ] [ -1.05e-05 3.84e-05 4.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.164450346479999e-14 -4.149637482059999e-14 1.77841606374e-14 ] [ -3.572853893819999e-14 -1.82648136276e-14 -1.16958894282e-14 ] [ -2.78778734316e-14 -1.602176634e-14 2.54746084806e-14 ] [ 2.83585264218e-14 -3.2844620997e-14 -1.50604603596e-14 ] [ 1.435550264064e-13 4.710399303959999e-14 -9.35671154256e-14 ] [ -1.6822854657e-14 6.152358274559999e-14 7.706469609539999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.74399305564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.362248116560887e-18 } }