{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1174888e-10 2.672625e-10 1.0616468e-10 ] [ 1.7827481e-10 4.9226442e-10 1.8569883e-10 ] [ 2.2292648e-10 3.0156325e-10 3.4441871e-10 ] [ 4.433854e-10 3.1015531e-10 9.192132e-11 ] [ 4.6289514e-10 2.8809922e-10 3.2609594e-10 ] [ 4.0361106e-10 5.4155178e-10 1.1595226e-10 ] [ 3.6731512e-10 5.078814300000001e-10 3.5178467e-10 ] ] "source-value" [ [ 2.1174888 2.672625 1.0616468 ] [ 1.7827481 4.9226442 1.8569883 ] [ 2.2292648 3.0156325 3.4441871 ] [ 4.433854 3.1015531 0.9192132 ] [ 4.6289514 2.8809922 3.2609594 ] [ 4.0361106 5.4155178 1.1595226 ] [ 3.6731512 5.0788143 3.5178467 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.14972194308608e-12 2.76343423555584e-12 -6.51989754068352e-12 ] [ -2.80573169834496e-12 2.4569378479968e-12 5.34982795451328e-12 ] [ 1.2320738213952e-12 -5.4738364249632e-12 9.6386945507328e-13 ] [ 4.66121244289344e-12 -2.3656137806112e-12 3.94519971105792e-12 ] [ -3.95385146481024e-12 3.140266176768e-12 1.64078907736128e-12 ] [ -2.07257567666688e-12 -1.994709892896e-12 -5.57429289908736e-12 ] [ 4.08859451861952e-12 1.47384227347392e-12 1.946644594272e-13 ] ] "source-value" [ [ -0.0007176 0.0017248 -0.0040694 ] [ -0.0017512 0.0015335 0.0033391 ] [ 0.000769 -0.0034165 0.0006016 ] [ 0.0029093 -0.0014765 0.0024624 ] [ -0.0024678 0.00196 0.0010241 ] [ -0.0012936 -0.001245 -0.0034792 ] [ 0.0025519 0.0009199 0.0001215 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" -3.596917115269458e-18 "source-value" -22.450191 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.53762043865343e-09 -1.492154351161354e-09 -1.996539899032278e-09 ] [ -8.682262399533274e-09 3.001758328335164e-09 -1.477544743426927e-09 ] [ -3.265967186600133e-09 -3.281175687955415e-09 2.113459058370482e-09 ] [ -4.591203252617977e-09 1.461924322462437e-09 3.206235158258792e-09 ] [ 6.508667083660023e-09 -1.883118771910266e-09 2.466629414376019e-10 ] [ 6.214680651373852e-09 1.016709880897912e-09 -2.32727866082298e-09 ] [ 2.278464665064081e-09 1.176056119113859e-09 2.350061452153095e-10 ] ] "source-value" [ [ 0.9597072 -0.9313295 -1.2461422 ] [ -5.419042 1.8735502 -0.9222109 ] [ -2.0384564 -2.0479488 1.3191174 ] [ -2.8656037 0.9124614 2.0011746 ] [ 4.0623905 -1.1753503 0.1539549 ] [ 3.8788986 0.6345804 -1.4525731 ] [ 1.4221058 0.7340365 0.1466793 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.244083697007274e-18 "source-value" -20.247978 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] "source-value" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] } "instance-id" 1 }