{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7972656 0.0944068 0.3511503 ] [ -0.6667876 1.5176773 0.0560659 ] [ 0.141317 -2.1083573 -0.048868 ] [ -0.0737093 1.5501147 -0.3820557 ] [ -2.4996365 -0.4990421 2.5221717 ] [ 0.1334775 -0.9157407 -0.05121 ] [ 1.1680733 0.3609414 -2.4472542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.879536925688084e-09 1.512563678045415e-10 5.626048010469062e-10 ] [ -1.068311503759342e-09 2.431587087978868e-09 8.982747420411072e-11 ] [ 2.264147935215936e-10 -3.377960774353012e-09 -7.82951671052544e-11 ] [ -1.180953171955334e-10 2.483557531898406e-09 -6.121207103833786e-10 ] [ -4.004859160798339e-09 -7.995535854149357e-10 4.040964531383391e-09 ] [ 2.13854529902832e-10 -1.467178340255027e-09 -8.2047464751168e-11 ] [ 1.871459732640705e-09 5.782918725588211e-10 -3.920933464394607e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.843695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.179310419928586e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6028794 2.5077523 1.9221853 ] [ 2.046865 2.7214882 4.2826763 ] [ 2.0421124 0.3112081 4.3881783 ] [ 3.6893273 0.3743663 2.5910692 ] [ 5.0068507 2.1841276 1.6237013 ] [ 4.1709806 1.4450767 4.7821216 ] [ 4.2959905 3.5147905 3.50642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6028794e-10 2.5077523e-10 1.9221853e-10 ] [ 2.046865e-10 2.7214882e-10 4.282676300000001e-10 ] [ 2.0421124e-10 3.112081e-11 4.3881783e-10 ] [ 3.6893273e-10 3.743663e-11 2.5910692e-10 ] [ 5.0068507e-10 2.1841276e-10 1.6237013e-10 ] [ 4.1709806e-10 1.4450767e-10 4.782121600000001e-10 ] [ 4.295990500000001e-10 3.5147905e-10 3.50642e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.25e-05 2.66e-05 -1.8e-06 ] [ 3e-07 -9.2e-06 -1.48e-05 ] [ 1.26e-05 -2.18e-05 1.14e-05 ] [ -1.1e-05 2.53e-05 2.53e-05 ] [ 2.37e-05 -1.9e-06 2.7e-06 ] [ -1.09e-05 3.4e-06 -1.07e-05 ] [ 7.8e-06 -2.24e-05 -1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.604897396800001e-14 4.261789811328e-14 -2.88391791744e-15 ] [ 4.8065298624e-16 -1.474002491136e-14 -2.371221398784e-14 ] [ 2.018742542208e-14 -3.492745033344e-14 1.826481347712e-14 ] [ -1.76239428288e-14 4.053506850624e-14 4.053506850624e-14 ] [ 3.797158591296e-14 -3.04413557952e-15 4.32587687616e-15 ] [ -1.746372516672e-14 5.44740051072e-15 -1.714328984256e-14 ] [ 1.249697764224e-14 -3.588875630592e-14 -1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.501501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.444920221430782e-18 } }