{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5912793 0.3477507 0.1919535 ] [ -1.8391175 -3.3308771 1.2808959 ] [ -8.2108953 -1.1095306 -1.720741 ] [ 4.5758251 -0.4352303 5.6686609 ] [ -4.4775704 2.9142924 -1.6003837 ] [ 5.2317259 7.4260572 -1.1950546 ] [ 3.1287529 -5.8124622 -2.6253309 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.549510491622989e-09 5.571580414068346e-10 3.075434099807328e-10 ] [ -2.946591061404144e-09 -5.336653416378104e-09 2.052221464658575e-09 ] [ -1.31553044854966e-08 -1.777663987382197e-09 -2.756931000652013e-09 ] [ 7.331279996089822e-09 -6.973158113237702e-10 9.082195965223087e-09 ] [ -7.173858612866105e-09 4.669211149455122e-09 -2.564097348449401e-09 ] [ 8.382148923413838e-09 1.189785523056351e-08 -1.914688540699496e-09 ] [ 5.012814748640201e-09 -9.312591046123734e-09 -4.206243789843822e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.05721 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.893083969887597e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7117041 1.3679821 1.7892239 ] [ 2.0050961 2.34192 3.9056584 ] [ 1.7106116 3.728134 1.7691658 ] [ 2.7088681 4.6723828 3.9336045 ] [ 4.3406987 2.9188843 3.0196662 ] [ 3.8504297 5.1387458 1.8344427 ] [ 3.8521827 3.0965157 0.5091441 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7117041e-10 1.3679821e-10 1.7892239e-10 ] [ 2.0050961e-10 2.34192e-10 3.9056584e-10 ] [ 1.7106116e-10 3.728134e-10 1.7691658e-10 ] [ 2.7088681e-10 4.6723828e-10 3.9336045e-10 ] [ 4.3406987e-10 2.9188843e-10 3.0196662e-10 ] [ 3.8504297e-10 5.1387458e-10 1.8344427e-10 ] [ 3.8521827e-10 3.0965157e-10 5.091441e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 5.9e-06 2.88e-05 ] [ 1.49e-05 5.1e-06 -3.44e-05 ] [ 8.48e-05 -1.83e-05 3.55e-05 ] [ 1.3e-06 -1.94e-05 -3.28e-05 ] [ -6.73e-05 1.1e-05 -4.33e-05 ] [ -9.3e-06 1.35e-05 1.29e-05 ] [ -1.68e-05 2.1e-06 3.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 9.45284206272e-15 4.614268667904e-14 ] [ 2.387243164992e-14 8.17110076608e-15 -5.511487575552001e-14 ] [ 1.3586457744384e-13 -2.931983216064e-14 5.68772700384e-14 ] [ 2.08282960704e-15 -3.108222644352e-14 -5.255139316223999e-14 ] [ -1.0782648657984e-13 1.76239428288e-14 -6.937424768064e-14 ] [ -1.490024257344e-14 2.16293843808e-14 2.066807840832e-14 ] [ -2.691656722944e-14 3.36457090368e-15 5.335248147264001e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }