{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6435311 1.1536262 -0.6977308 ] [ 0.4646179 -0.3434839 0.0793562 ] [ -0.0523099 1.0133027 0.7468786 ] [ 0.3859581 -1.0797912 -0.4519805 ] [ 0.6693718 -0.2260917 -0.268973 ] [ -0.8228335 -1.0113255 0.1907627 ] [ -0.0012732 0.4937635 0.4016868 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.031050483177707e-09 1.848312926782345e-09 -1.117887975372081e-09 ] [ 7.443999369851923e-10 -5.503218742012051e-10 1.27142648355529e-10 ] [ -8.380969881638592e-11 1.623489895733516e-09 1.196631431495835e-09 ] [ 6.183730444283885e-10 -1.730016215985577e-09 -7.241525901574944e-10 ] [ 1.072451848582813e-09 -3.622388358969274e-10 -4.309422522264384e-10 ] [ -1.318324596511037e-09 -1.620322072118871e-09 3.056355380606842e-10 ] [ -2.03989127360256e-12 7.910963359043808e-10 6.435731998439655e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.255587158928929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.162473211621262e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9395059 4.0189445 3.19436 ] [ 5.471233 2.2067866 1.4943906 ] [ 3.5890393 0.9430406 0.7214956 ] [ 3.30713 1.6201928 3.0016416 ] [ 5.1321292 3.0443851 3.7548666 ] [ 4.9132393 4.5539354 1.8197046 ] [ 3.0671282 3.2753353 0.879828 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9395059e-10 4.0189445e-10 3.19436e-10 ] [ 5.471233e-10 2.2067866e-10 1.4943906e-10 ] [ 3.5890393e-10 9.430406e-11 7.214956000000001e-11 ] [ 3.30713e-10 1.6201928e-10 3.0016416e-10 ] [ 5.1321292e-10 3.0443851e-10 3.7548666e-10 ] [ 4.9132393e-10 4.553935400000001e-10 1.8197046e-10 ] [ 3.0671282e-10 3.2753353e-10 8.79828e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.12e-05 -1.22e-05 -1.9e-06 ] [ -2.09e-05 3.5e-06 1.67e-05 ] [ 9.8e-06 4.9e-06 1.29e-05 ] [ -1.2e-06 1e-07 -1.14e-05 ] [ -2.8e-06 -5.6e-06 -1.35e-05 ] [ -4.4e-06 2.1e-06 -1.07e-05 ] [ 8.3e-06 7.3e-06 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.794437815296e-14 -1.954655477376e-14 -3.04413557952e-15 ] [ -3.348549137472e-14 5.6076181728e-15 2.675634956736e-14 ] [ 1.570133088384e-14 7.850665441919999e-15 2.066807840832e-14 ] [ -1.92261194496e-15 1.6021766208e-16 -1.826481347712e-14 ] [ -4.48609453824e-15 -8.972189076479999e-15 -2.16293843808e-14 ] [ -7.04957713152e-15 3.36457090368e-15 -1.714328984256e-14 ] [ 1.329806595264e-14 1.169588933184e-14 1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.101010158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297924908149922e-18 } }