{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9458975 -1.1491737 -2.2737188 ] [ 2.21e-05 -3.459295 6.6262126 ] [ -7.9747396 1.4781418 -4.3266981 ] [ -1.8754512 0.1607494 -9.532887 ] [ 4.5316665 -1.5493926 6.4752465 ] [ 3.0765103 1.2505433 -4.0196225 ] [ 3.1878895 3.2684267 7.0514673 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.515494860173168e-09 -1.841179235378233e-09 -3.642899103633431e-09 ] [ 3.540810331968e-14 -5.542401573450335e-09 1.061636291217038e-08 ] [ -1.277694134408795e-08 2.368244234187229e-09 -6.932134541079781e-09 ] [ -3.004804066091305e-09 2.575489304876275e-10 -1.527336868012825e-08 ] [ 7.260530119562563e-09 -2.482400600160526e-09 1.037448855621703e-08 ] [ 4.929112876310395e-09 2.003591238558081e-09 -6.440145193941647e-09 ] [ 5.107562026593802e-09 5.236596845538496e-09 1.12976960503957e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.889416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.385547421256545e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9801216 1.7188501 2.7162266 ] [ 3.0152274 1.8303623 4.9186017 ] [ 1.7477554 4.1437478 2.7016839 ] [ 4.1727856 1.9218329 1.6744222 ] [ 5.320097 1.7001278 3.9074386 ] [ 3.8431786 4.3958031 1.324181 ] [ 2.4943344 4.2892181 5.1044529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9801216e-10 1.7188501e-10 2.716226600000001e-10 ] [ 3.0152274e-10 1.8303623e-10 4.9186017e-10 ] [ 1.7477554e-10 4.1437478e-10 2.7016839e-10 ] [ 4.1727856e-10 1.9218329e-10 1.6744222e-10 ] [ 5.320097e-10 1.7001278e-10 3.9074386e-10 ] [ 3.8431786e-10 4.3958031e-10 1.324181e-10 ] [ 2.4943344e-10 4.289218100000001e-10 5.1044529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 9.8e-06 -1.7e-06 ] [ -1.8e-06 -1.2e-06 -6.5e-06 ] [ -4.3e-06 5.2e-06 -3.4e-06 ] [ 2.1e-06 -1.03e-05 6.1e-06 ] [ 1.19e-05 1.9e-06 1.3e-06 ] [ -6.4e-06 -1.7e-06 5.2e-06 ] [ 1.6e-06 -3.7e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 1.570133088384e-14 -2.72370025536e-15 ] [ -2.88391791744e-15 -1.92261194496e-15 -1.04141480352e-14 ] [ -6.889359469440001e-15 8.33131842816e-15 -5.44740051072e-15 ] [ 3.36457090368e-15 -1.650241919424e-14 9.77327738688e-15 ] [ 1.906590178752e-14 3.04413557952e-15 2.08282960704e-15 ] [ -1.025393037312e-14 -2.72370025536e-15 8.33131842816e-15 ] [ 2.56348259328e-15 -5.928053496960001e-15 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733309136689e-18 } }