{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5253665 0.557767 0.8131294 ] [ 1.8477738 -15.3551239 6.6612393 ] [ -4.6210373 14.4949076 -5.8975765 ] [ -15.7481632 -29.9026217 -34.0625977 ] [ 19.015759 25.45205 33.8344379 ] [ -1.0196988 4.753021 -1.3486323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.417299236515232e-10 8.936412472537537e-10 1.302776914365132e-09 ] [ 2.960459982886775e-09 -2.460162052206732e-08 1.067248187201416e-08 ] [ -7.403717925904757e-09 2.322340207737624e-08 -9.448959187679493e-09 ] [ -2.523133889958292e-08 -4.790928138836675e-08 -5.457429767865585e-08 ] [ 3.046660449656719e-08 4.077867946143264e-08 5.420874538128945e-08 ] [ -1.633737577617815e-09 7.615179124371437e-09 -2.160747141115732e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.95048404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522843307331532e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.226951 1.0336801 0.5501772 ] [ 0.7821018 0.5733048 3.083694 ] [ -0.2716957 2.7252002 2.2970746 ] [ 2.4373961 -0.0419582 1.1291312 ] [ 3.2628227 1.0052453 3.2228294 ] [ 2.1351255 2.537803 1.5676924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.26951e-11 1.0336801e-10 5.501772e-11 ] [ 7.821018e-11 5.733048e-11 3.083694e-10 ] [ -2.716957e-11 2.7252002e-10 2.2970746e-10 ] [ 2.4373961e-10 -4.195820000000001e-12 1.1291312e-10 ] [ 3.2628227e-10 1.0052453e-10 3.2228294e-10 ] [ 2.1351255e-10 2.537803e-10 1.5676924e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 -7.7e-06 -2.05e-05 ] [ -2.8e-06 -5e-07 2.57e-05 ] [ 7.5e-06 -1.21e-05 -7e-07 ] [ -9e-06 1.35e-05 1.3e-06 ] [ -1.1e-05 3.5e-06 -1.39e-05 ] [ 1.88e-05 3.3e-06 8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.6076181728e-15 -1.233675998016e-14 -3.28446207264e-14 ] [ -4.48609453824e-15 -8.010883104e-16 4.117593915456e-14 ] [ 1.2016324656e-14 -1.938633711168e-14 -1.12152363456e-15 ] [ -1.44195895872e-14 2.16293843808e-14 2.08282960704e-15 ] [ -1.76239428288e-14 5.6076181728e-15 -2.227025502912e-14 ] [ 3.012092047104e-14 5.28718284864e-15 1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }