{ "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" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.333097 -1.8803924 -3.7884926 ] [ -4.707005 -3.7761663 5.2513316 ] [ 1.4022878 -5.6033882 -5.3294861 ] [ 8.7005656 -5.0266386 6.8854963 ] [ 4.1043181 3.2829801 -3.1132317 ] [ -5.1670694 13.0036053 0.0943825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.942386709058618e-09 -3.012720741210002e-09 -6.069834271793806e-09 ] [ -7.541453364988704e-09 -6.050085362112839e-09 8.413560717588258e-09 ] [ 2.246712728793067e-09 -8.977617571306597e-09 -8.53877803029857e-09 ] [ 1.393984279205672e-08 -8.053562846130844e-09 1.10317811944649e-08 ] [ 6.575842504146277e-09 5.259913962771646e-09 -4.98794704487344e-09 ] [ -8.278557790731084e-09 2.083407239777097e-08 1.51217434912656e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3017125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.490298630090312e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1019541 1.9442515 2.3303394 ] [ 2.7482976 2.153948 4.8387045 ] [ 4.3733982 1.3947518 1.791075 ] [ 5.0197464 1.604446 4.2994458 ] [ 5.1534611 3.6828137 2.7450299 ] [ 2.8820086 4.232312 3.2842804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1019541e-10 1.9442515e-10 2.3303394e-10 ] [ 2.7482976e-10 2.153948e-10 4.8387045e-10 ] [ 4.3733982e-10 1.3947518e-10 1.791075e-10 ] [ 5.0197464e-10 1.604446e-10 4.2994458e-10 ] [ 5.1534611e-10 3.6828137e-10 2.7450299e-10 ] [ 2.8820086e-10 4.232312000000001e-10 3.2842804e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 2.2e-05 2e-06 ] [ 3.5e-06 7.1e-06 2.02e-05 ] [ 5.25e-05 3.66e-05 2.56e-05 ] [ -2.88e-05 4.15e-05 -5.35e-05 ] [ -4.06e-05 -8.13e-05 -2e-07 ] [ 1.28e-05 -2.58e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 3.52478856576e-14 3.2043532416e-15 ] [ 5.6076181728e-15 1.137545400768e-14 3.236396774016e-14 ] [ 8.4114272592e-14 5.863966432128e-14 4.101572149248001e-14 ] [ -4.614268667904e-14 6.64903297632e-14 -8.57164492128e-14 ] [ -6.504837080448e-14 -1.3025695927104e-13 -3.2043532416e-16 ] [ 2.050786074624e-14 -4.133615681664e-14 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.148122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.426996691742614e-18 } }