{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8066599 -15.4713497 4.8719899 ] [ -9.245745 10.4288214 -15.721363 ] [ 6.5239976 10.8233842 14.459895 ] [ 8.4267935 -6.723894 -2.2558883 ] [ 1.1016138 0.9430381 -1.3546337 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.090547135751687e-08 -2.478783478156109e-08 7.80578831455373e-09 ] [ -1.481331648087849e-08 1.670881382957873e-08 -2.518840024571015e-08 ] [ 1.045259642887531e-08 1.734097312317611e-08 2.316730570822282e-08 ] [ 1.350121153400941e-08 -1.077286576753739e-08 -3.614331493396257e-09 ] [ 1.764979875510647e-09 1.510913596343653e-09 -2.170362443887801e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.73300277 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.17439990107564e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8003399 -0.0734178 2.8080103 ] [ 0.8006651 3.4836874 1.3613798 ] [ 0.1709742 2.0349891 2.8998846 ] [ 1.996288 -1.3028011 1.423555 ] [ 2.0900856 3.4247239 -0.4187172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.003399e-11 -7.34178e-12 2.8080103e-10 ] [ 8.006651e-11 3.4836874e-10 1.3613798e-10 ] [ 1.709742e-11 2.0349891e-10 2.8998846e-10 ] [ 1.996288e-10 -1.3028011e-10 1.423555e-10 ] [ 2.0900856e-10 3.4247239e-10 -4.187172e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.262486 -0.3343167 -0.2969463 ] [ -0.2017262 -0.1945201 0.4045014 ] [ 0.1807918 0.2158277 -0.3684098 ] [ -0.3042076 0.1174385 0.4372302 ] [ 0.0626561 0.1955706 -0.1763755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.205489324873088e-10 -5.356344006830075e-10 -4.75760419493063e-10 ] [ -3.232010014428249e-10 -3.116555564956781e-10 6.480826861608692e-10 ] [ 2.896603951923494e-10 3.457940950610362e-10 -5.902575684336039e-10 ] [ -4.873943045896781e-10 1.881572190818208e-10 7.005200043477082e-10 ] [ 1.003861385705069e-10 3.133386430358285e-10 -2.825847025819104e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.73193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719444734206214e-18 } }