{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.5391733 -10.0456381 20.2874973 ] [ -4.6836898 1.8087633 4.9568633 ] [ 9.5499155 -31.3848778 7.247198 ] [ 112.0509779 27.9875746 24.7180804 ] [ -100.3780302 11.6341779 -57.209639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.649867678861959e-08 -1.609488650483773e-08 3.250415386860312e-08 ] [ -7.504098296639429e-09 2.897958271821057e-09 7.941770491761538e-09 ] [ 1.530065134471554e-08 -5.028411745782494e-08 1.161129120190852e-08 ] [ 1.795254571291575e-07 4.484103769701591e-08 3.960273052793472e-08 ] [ -1.608233332283963e-07 1.864000783360804e-08 -9.16599460902079e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.384601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.989673370013631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0430102 0.3460837 3.0815904 ] [ -0.1446949 2.0033863 1.9680926 ] [ 3.1257244 0.1530311 2.0705482 ] [ 3.2252124 1.6910271 0.3322022 ] [ 1.2039709 2.8345935 0.2688661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0430102e-10 3.460837e-11 3.0815904e-10 ] [ -1.446949e-11 2.0033863e-10 1.9680926e-10 ] [ 3.125724400000001e-10 1.530311e-11 2.0705482e-10 ] [ 3.2252124e-10 1.6910271e-10 3.322022e-11 ] [ 1.2039709e-10 2.8345935e-10 2.688661e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 2.1e-06 -4.7e-06 ] [ -4.7e-06 -1.1e-06 -8.1e-06 ] [ 6.1e-06 6.1e-06 2.1e-06 ] [ -5.3e-06 -1.41e-05 -1.3e-06 ] [ 2e-07 7e-06 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 3.36457090368e-15 -7.53023011776e-15 ] [ -7.53023011776e-15 -1.76239428288e-15 -1.297763062848e-14 ] [ 9.77327738688e-15 9.77327738688e-15 3.36457090368e-15 ] [ -8.491536090240001e-15 -2.259069035328e-14 -2.08282960704e-15 ] [ 3.2043532416e-16 1.12152363456e-14 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360461099259e-18 } }