{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.4023241 3.9521827 -42.749392 ] [ 51.4591938 -13.5431108 -36.6611965 ] [ -21.4909686 7.5287346 -33.8781204 ] [ -6.4429832 -48.592054 -0.3613888 ] [ 9.8770821 50.6542475 113.6500976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.351642319431508e-08 6.33209477523903e-09 -6.849207698010652e-08 ] [ 8.244671791083767e-08 -2.169845567543304e-08 -5.873771240678258e-08 ] [ -3.443232773294768e-08 1.206236265970734e-08 -5.427873290871873e-08 ] [ -1.032279713629455e-08 -7.785305351686622e-08 -5.790086911492991e-10 ] [ 1.582483015271965e-08 8.11570517573529e-08 1.820875308265395e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 39.445823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.319917591949977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2709861 3.9988693 2.1729257 ] [ 5.9096902 2.8333192 1.9491554 ] [ 3.525012 2.1561603 0.3457558 ] [ 3.7618055 0.5298693 2.7983683 ] [ 4.0633283 3.0893735 4.2385908 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2709861e-10 3.9988693e-10 2.1729257e-10 ] [ 5.909690200000001e-10 2.8333192e-10 1.9491554e-10 ] [ 3.525012e-10 2.1561603e-10 3.457558e-11 ] [ 3.7618055e-10 5.298693e-11 2.7983683e-10 ] [ 4.0633283e-10 3.089373500000001e-10 4.2385908e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.72e-05 2.62e-05 -8.65e-05 ] [ -7.34e-05 -4.42e-05 3.22e-05 ] [ -5.41e-05 2.2e-05 9.2e-06 ] [ 9.24e-05 3.63e-05 -1.9e-06 ] [ 1.79e-05 -4.03e-05 4.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.75574381048e-14 4.197702781079999e-14 -1.38588278841e-13 ] [ -1.175997649356e-13 -7.08162072228e-14 5.159008761479998e-14 ] [ -8.66777558994e-14 3.5247885948e-14 1.47400250328e-14 ] [ 1.480411209816e-13 5.81590118142e-14 -3.0441356046e-15 ] [ 2.86789617486e-14 -6.456771835019998e-14 7.530230179799998e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.94399396928671e-18 } }