{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.869196e-10 8.171533e-11 9.671775000000001e-11 ] [ 2.5086291e-10 1.544976e-11 3.0108661e-10 ] [ 2.6219109e-10 2.876571e-10 5.014098e-11 ] ] "source-value" [ [ 1.869196 0.8171533 0.9671775 ] [ 2.5086291 0.1544976 3.0108661 ] [ 2.6219109 2.876571 0.5014098 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.7742445413632e-13 -3.5632408046592e-13 -8.799154001433601e-13 ] [ 3.8676543626112e-13 1.16462218565952e-12 -3.468712384032e-13 ] [ 1.906590178752e-13 -8.082981051936e-13 1.22694685620864e-12 ] ] "source-value" [ [ -0.0003604 -0.0002224 -0.0005492 ] [ 0.0002414 0.0007269 -0.0002165 ] [ 0.000119 -0.0005045 0.0007658 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.05580329485899e-18 "source-value" -6.5898059 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.645029846615343e-08 -6.952254995519111e-09 -2.830586136089301e-08 ] [ 9.535158052272813e-09 -1.45395677823603e-08 3.518595784619986e-08 ] [ 6.915140574098279e-09 2.149182261766175e-08 -6.880096485306846e-09 ] ] "source-value" [ [ -10.2674688 -4.3392563 -17.6671292 ] [ 5.9513776 -9.0748845 21.9613477 ] [ 4.3160913 13.4141407 -4.2942185 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 7.243789456704811e-23 "source-value" 0.00045212178 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.027774e-10 9.499662e-11 1.173504e-10 ] [ 2.431627e-10 2.783967e-11 2.720162e-10 ] [ 2.540335e-10 2.619859e-10 5.857874e-11 ] ] "source-value" [ [ 2.027774 0.9499662 1.173504 ] [ 2.431627 0.2783967 2.720162 ] [ 2.540335 2.619859 0.5857874 ] ] } "instance-id" 1 }