{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5803255 -1.3302319 1.606432 ] [ -3.9331663 0.9781363 -0.4691806 ] [ 7.2963013 -9.9240836 8.4465914 ] [ 2.8276837 7.5946795 -6.3070051 ] [ 2.3895067 2.6814997 -3.2768378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.374719691495407e-08 -2.131266450422364e-09 2.573787793304986e-09 ] [ -6.30162709157844e-09 1.567147111815815e-09 -7.517101882529165e-10 ] [ 1.168996336117265e-08 -1.59001347267847e-08 1.353293126653034e-08 ] [ 4.530448715157241e-09 1.216801793736903e-08 -1.010493611848636e-08 ] [ 3.828411769984959e-09 4.296236128022214e-09 -5.250072913313707e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4863235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.79005924584563e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0906955 0.5596827 2.3715142 ] [ 0.0492083 2.2039678 0.7900969 ] [ 2.2695424 0.1674305 2.9238529 ] [ 3.5746132 1.5696263 1.6841255 ] [ 2.2024131 2.8279131 0.3650035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.06955e-12 5.596827e-11 2.3715142e-10 ] [ 4.92083e-12 2.2039678e-10 7.900969e-11 ] [ 2.2695424e-10 1.674305e-11 2.9238529e-10 ] [ 3.5746132e-10 1.5696263e-10 1.6841255e-10 ] [ 2.2024131e-10 2.8279131e-10 3.650035e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.64e-05 -4.88e-05 3.33e-05 ] [ 1.75e-05 2.71e-05 -5.16e-05 ] [ -6.15e-05 3.73e-05 1.42e-05 ] [ 1.68e-05 -1.52e-05 -5.57e-05 ] [ -1.92e-05 -4e-07 5.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.434099520512001e-14 -7.818621909504e-14 5.335248147264001e-14 ] [ 2.8038090864e-14 4.341898642368e-14 -8.267231363328e-14 ] [ -9.853386217920001e-14 5.976118795584e-14 2.275090801536e-14 ] [ 2.691656722944e-14 -2.435308463616e-14 -8.924123777856e-14 ] [ -3.076179111936e-14 -6.408706483200001e-16 9.581016192383999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.078031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.935113889349764e-18 } }