{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6680867 -12.701454 -15.841226 ] [ -10.4551711 -8.2554984 4.5836226 ] [ 3.5186819 6.5104893 6.7285984 ] [ -9.5009481 15.879437 3.4737665 ] [ -1.2612641 -2.1746492 -0.6327883 ] [ 12.0289878 -0.8748127 -2.6910684 ] [ 4.0016269 1.6164881 4.3790952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.672569512207423e-09 -2.034997264896665e-08 -2.53804419420091e-08 ] [ -1.675103070288382e-08 -1.322676652953181e-08 7.34377296829051e-09 ] [ 5.637549876212123e-09 1.043095374642856e-08 1.078040304723229e-08 ] [ -1.522219692125418e-08 2.544166271286649e-08 5.565587472418243e-09 ] [ -2.020767853674353e-09 -3.484172106681424e-09 -1.013838620175777e-09 ] [ 1.927256302504842e-08 -1.401604455518924e-09 -4.311566875453663e-09 ] [ 6.411313064344379e-09 2.589899441621412e-09 7.016083949697501e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.276523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806698151451348e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1065815 1.301693 1.738856 ] [ 1.5074011 0.5049041 4.0689917 ] [ 2.1274751 2.6682892 5.0822535 ] [ 2.2041816 3.6017809 2.7988046 ] [ 3.8764374 0.0732583 3.2785624 ] [ 4.4161016 2.4718205 2.2947981 ] [ 4.4893067 2.0156966 4.7867896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1065815e-10 1.301693e-10 1.738856e-10 ] [ 1.5074011e-10 5.049041e-11 4.0689917e-10 ] [ 2.1274751e-10 2.6682892e-10 5.082253500000001e-10 ] [ 2.2041816e-10 3.6017809e-10 2.7988046e-10 ] [ 3.8764374e-10 7.32583e-12 3.2785624e-10 ] [ 4.4161016e-10 2.471820500000001e-10 2.2947981e-10 ] [ 4.489306700000001e-10 2.0156966e-10 4.7867896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 2.4e-06 -6.7e-06 ] [ -3.1e-06 -8.8e-06 3.2e-06 ] [ -6.3e-06 4.7e-06 1.2e-06 ] [ -0.0 1.4e-06 8.9e-06 ] [ -8.6e-06 -6.5e-06 5.3e-06 ] [ 6e-07 2.4e-06 -6.5e-06 ] [ 7.1e-06 4.5e-06 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.666263685632e-14 3.84522388992e-15 -1.073458335936e-14 ] [ -4.96674752448e-15 -1.409915426304e-14 5.126965186560001e-15 ] [ -1.009371271104e-14 7.53023011776e-15 1.92261194496e-15 ] [ 0.0 2.24304726912e-15 1.425937192512e-14 ] [ -1.377871893888e-14 -1.04141480352e-14 8.491536090240001e-15 ] [ 9.6130597248e-16 3.84522388992e-15 -1.04141480352e-14 ] [ 1.137545400768e-14 7.2097947936e-15 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }