{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3602467 -3.0027009 0.8989127 ] [ -1.0366897 -0.452157 -1.2418282 ] [ -2.3716783 1.7616413 0.5367013 ] [ 1.0921117 1.3218995 1.3676145 ] [ -4.6942218 2.0393937 0.0020305 ] [ 2.0616731 -1.9071597 0.1145512 ] [ -0.4114416 0.239083 -1.677982 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.588061944460351e-09 -4.810857181235118e-09 1.440216912080204e-09 ] [ -1.660960000364166e-09 -7.244353743310656e-10 -1.989628109090147e-09 ] [ -3.799847524318689e-09 2.822460505095719e-09 8.598902752129671e-10 ] [ 1.749755833042143e-09 2.11791647394721e-09 2.191159978167082e-09 ] [ -7.520972420809695e-09 3.267468906746809e-09 3.2532196285344e-12 ] [ 3.303164440552261e-09 -3.055606683471942e-09 1.83531254524585e-10 ] [ -6.592021123445454e-10 3.830531930307264e-10 -2.688423530523226e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.197519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.51774057063638e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.651083 1.3231453 2.0104537 ] [ 2.5196688 0.4609834 4.0026204 ] [ 2.4665618 2.6356814 4.9276903 ] [ 1.5994618 3.4369969 2.9096402 ] [ 3.9717498 1.2295443 2.2792149 ] [ 4.5273181 1.5653666 4.5418909 ] [ 3.9186417 3.4042409 3.2042817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.651083e-10 1.3231453e-10 2.0104537e-10 ] [ 2.5196688e-10 4.609834e-11 4.0026204e-10 ] [ 2.4665618e-10 2.6356814e-10 4.927690300000001e-10 ] [ 1.5994618e-10 3.4369969e-10 2.9096402e-10 ] [ 3.9717498e-10 1.2295443e-10 2.2792149e-10 ] [ 4.5273181e-10 1.5653666e-10 4.5418909e-10 ] [ 3.9186417e-10 3.4042409e-10 3.2042817e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.2e-06 -1.3e-05 -6.4e-06 ] [ -7.5e-06 7.1e-06 -1.3e-06 ] [ -4e-07 -7e-07 -1.74e-05 ] [ -2.14e-05 9.6e-06 6.4e-06 ] [ 4.2e-06 -1.05e-05 -9e-07 ] [ 1.23e-05 1.5e-05 -7.9e-06 ] [ 2.1e-05 -7.4e-06 2.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.313784829056e-14 -2.08282960704e-14 -1.025393037312e-14 ] [ -1.2016324656e-14 1.137545400768e-14 -2.08282960704e-15 ] [ -6.408706483200001e-16 -1.12152363456e-15 -2.787787320192e-14 ] [ -3.428657968511999e-14 1.538089555968e-14 1.025393037312e-14 ] [ 6.72914180736e-15 -1.68228545184e-14 -1.44195895872e-15 ] [ 1.970677243584e-14 2.4032649312e-14 -1.265719530432e-14 ] [ 3.36457090368e-14 -1.185610699392e-14 4.389963940992e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.295431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.853863126525957e-18 } }