{ "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" [ [ 2.887739 1.995765 3.859098 ] [ 2.327199 3.871069 1.984027 ] [ 1.151407 3.535975 3.566474 ] [ 2.937456 4.643275 4.143131 ] [ 3.294842 1.915913 1.493263 ] [ 5.055976 2.713207 3.11233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.887739e-10 1.995765e-10 3.859098e-10 ] [ 2.327199e-10 3.871069e-10 1.984027e-10 ] [ 1.151407e-10 3.535975e-10 3.566474e-10 ] [ 2.937456e-10 4.643275e-10 4.143131e-10 ] [ 3.294842e-10 1.915913e-10 1.493263e-10 ] [ 5.055976000000001e-10 2.713207e-10 3.11233e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.386427 1.6104518 -0.4158301 ] [ 5.0896477 1.0922926 -4.140462 ] [ -7.2248472 -2.286057 4.4006009 ] [ 4.4933054 -1.3559709 0.2719261 ] [ 1.3309568 -1.1109117 0.3974166 ] [ -4.0754897 2.0501951 -0.5136515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.191243050458817e-10 2.580228222885277e-09 -6.66233264444926e-10 ] [ 8.154514553048492e-09 1.750045666792846e-09 -6.63375141571081e-09 ] [ -1.157548127269234e-08 -3.662667079216186e-09 7.050539879451438e-09 ] [ 7.199068861994392e-09 -2.172504874465135e-09 4.356736400053229e-10 ] [ 2.132427868254782e-09 -1.779876753513183e-09 6.367315852378253e-10 ] [ -6.529654315651206e-09 3.284774657298718e-09 -8.229604245388513e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.303456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.092754590384149e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7206793 2.0449604 3.7449675 ] [ 2.5789243 3.8011304 1.9780801 ] [ 0.9284315 3.6642422 3.7363316 ] [ 3.1731338 4.3918555 4.2794368 ] [ 3.5090687 1.6236159 1.501039 ] [ 4.7443813 3.1493997 2.918468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7206793e-10 2.0449604e-10 3.7449675e-10 ] [ 2.5789243e-10 3.8011304e-10 1.9780801e-10 ] [ 9.284315e-11 3.6642422e-10 3.7363316e-10 ] [ 3.1731338e-10 4.3918555e-10 4.2794368e-10 ] [ 3.5090687e-10 1.6236159e-10 1.501039e-10 ] [ 4.7443813e-10 3.1493997e-10 2.918468e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.74e-05 2.84e-05 -6.5e-06 ] [ 1.37e-05 -3.28e-05 6.37e-05 ] [ -3.15e-05 -0.0 -2.03e-05 ] [ 2.05e-05 -1.55e-05 -1.04e-05 ] [ 2.93e-05 3.66e-05 2.88e-05 ] [ -1.46e-05 -1.67e-05 -5.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.787787320192e-14 4.550181603071999e-14 -1.04141480352e-14 ] [ 2.194981970496e-14 -5.255139316223999e-14 1.0205865074496e-13 ] [ -5.04685635552e-14 0.0 -3.252418540224e-14 ] [ 3.28446207264e-14 -2.48337376224e-14 -1.666263685632e-14 ] [ 4.694377498944e-14 5.863966432128e-14 4.614268667904e-14 ] [ -2.339177866368e-14 -2.675634956736e-14 -8.860036713024e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }