{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.8857422e-10 2.6267866e-10 1.0625231e-10 ] [ 1.8357944e-10 2.2174514e-10 3.205957e-10 ] [ 2.346435e-10 4.4834429e-10 2.5217033e-10 ] [ 4.1474486e-10 1.5892558e-10 2.8503783e-10 ] [ 4.6577451e-10 3.8555843e-10 2.1647897e-10 ] [ 3.6078638e-10 3.4454501e-10 4.3090967e-10 ] ] "source-value" [ [ 2.8857422 2.6267866 1.0625231 ] [ 1.8357944 2.2174514 3.205957 ] [ 2.346435 4.4834429 2.5217033 ] [ 4.1474486 1.5892558 2.8503783 ] [ 4.6577451 3.8555843 2.1647897 ] [ 3.6078638 3.4454501 4.3090967 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.020102930208e-13 1.5084492884832e-12 -8.060550579244801e-13 ] [ -3.10694090305536e-12 -2.74436833376832e-12 2.00416273495872e-12 ] [ -4.34446212496128e-12 6.08074092892224e-12 -3.25770572307264e-12 ] [ 4.07737928227392e-12 -3.91123356669696e-12 -1.2865478265024e-13 ] [ 1.093485543696e-12 -1.48617903345408e-12 2.6764360450464e-12 ] [ 2.58254849506752e-12 5.5259071651392e-13 -4.8818321635776e-13 ] ] "source-value" [ [ -0.0001885 0.0009415 -0.0005031 ] [ -0.0019392 -0.0017129 0.0012509 ] [ -0.0027116 0.0037953 -0.0020333 ] [ 0.0025449 -0.0024412 -8.03e-05 ] [ 0.0006825 -0.0009276 0.0016705 ] [ 0.0016119 0.0003449 -0.0003047 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.770199426337168e-18 "source-value" -17.290225 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.384721659426185e-09 -1.158039643012963e-09 -3.923140462689759e-09 ] [ -2.819646442078947e-09 -4.396255528364219e-09 4.054859087691956e-09 ] [ 1.409159198938982e-10 5.34015096794131e-09 4.75802236302866e-10 ] [ 1.438986921088416e-10 2.598309106486329e-10 7.536106901605094e-10 ] [ 8.621825093043458e-10 3.81353924506706e-10 8.34838160917152e-10 ] [ -7.120723386543246e-10 -4.270406317194662e-10 -2.195969712382723e-09 ] ] "source-value" [ [ 1.4884262 -0.7227915 -2.4486317 ] [ -1.7598849 -2.7439269 2.530844 ] [ 0.0879528 3.3330601 0.2969724 ] [ 0.0898145 0.1621737 0.4703668 ] [ 0.538132 0.2380224 0.521065 ] [ -0.4444406 -0.2665378 -1.3706165 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.597446174158367e-18 "source-value" -16.211984 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.965438e-10 2.618572e-10 1.194827e-10 ] [ 1.728438e-10 2.327042e-10 2.925955e-10 ] [ 2.189414e-10 4.329945000000001e-10 2.407266e-10 ] [ 3.949135e-10 1.445792e-10 2.998392e-10 ] [ 4.502281e-10 4.108784e-10 2.139004e-10 ] [ 4.146323e-10 3.387836e-10 4.449004000000001e-10 ] ] "source-value" [ [ 2.965438 2.618572 1.194827 ] [ 1.728438 2.327042 2.925955 ] [ 2.189414 4.329945 2.407266 ] [ 3.949135 1.445792 2.998392 ] [ 4.502281 4.108784 2.139004 ] [ 4.146323 3.387836 4.449004 ] ] } "instance-id" 1 }