{ "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" [ [ 0.19695 0.77855 2.710152 ] [ 1.11009 0.0001542 2.008775 ] [ 0.4144899 1.96716 0.2031325 ] [ 1.283205 2.99395 1.505794 ] [ 2.698669 0.3602939 2.825256 ] [ 2.163799 2.696333 2.742799 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9695e-11 7.7855e-11 2.710152e-10 ] [ 1.11009e-10 1.542e-14 2.008775e-10 ] [ 4.144899e-11 1.96716e-10 2.031325e-11 ] [ 1.283205e-10 2.99395e-10 1.505794e-10 ] [ 2.698669e-10 3.602939e-11 2.825256e-10 ] [ 2.163799e-10 2.696333e-10 2.742799e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -62.9319448 58.8020917 49.2812793 ] [ 48.727671 -61.1300861 -61.7138418 ] [ -7.6811589 -11.8124032 -8.9109902 ] [ -26.1110599 20.5208055 -35.2207802 ] [ 13.7061196 7.0513098 8.4537153 ] [ 34.290373 -13.4317176 48.1106176 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.008280906600361e-07 9.421133657587774e-08 7.8957313537575e-08 ] [ 7.807033526223416e-08 -9.794119477691105e-08 -9.887647451170979e-08 ] [ -1.230657321022985e-08 -1.892555624250311e-08 -1.427698016661792e-08 ] [ -4.183452971608839e-08 3.287795481208406e-08 -5.642991060277555e-08 ] [ 2.195962438500865e-08 1.129744370757793e-08 1.354434501255926e-08 ] [ 5.493923393911156e-08 -2.151998391590789e-08 7.7081706730969e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.345548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.38123976885642e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4367598 1.3836778 2.6942634 ] [ 1.2263012 -0.3849902 1.3119851 ] [ 0.2653546 1.4659358 0.3223206 ] [ 0.9914137 3.3398486 1.4581351 ] [ 2.5462402 0.3449432 3.0594811 ] [ 2.4011334 2.6470259 3.1497232 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.367598e-11 1.3836778e-10 2.6942634e-10 ] [ 1.2263012e-10 -3.849902e-11 1.3119851e-10 ] [ 2.653546e-11 1.4659358e-10 3.223206e-11 ] [ 9.914137e-11 3.3398486e-10 1.4581351e-10 ] [ 2.5462402e-10 3.449432e-11 3.0594811e-10 ] [ 2.4011334e-10 2.6470259e-10 3.1497232e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 1.4e-06 -5.5e-06 ] [ -2.9e-06 -9e-06 -2.2e-06 ] [ -4e-06 1.8e-06 6e-07 ] [ 2e-07 1.4e-06 -4e-07 ] [ 1.1e-06 2e-06 1.8e-06 ] [ -1.3e-06 2.5e-06 5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.105501868352e-14 2.24304726912e-15 -8.8119714144e-15 ] [ -4.646312200320001e-15 -1.44195895872e-14 -3.52478856576e-15 ] [ -6.4087064832e-15 2.88391791744e-15 9.6130597248e-16 ] [ 3.2043532416e-16 2.24304726912e-15 -6.408706483200001e-16 ] [ 1.76239428288e-15 3.2043532416e-15 2.88391791744e-15 ] [ -2.08282960704e-15 4.005441552e-15 9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.896573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.828653057784052e-18 } }