{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -345.6709529 1077.4195403 866.5687748 ] [ 7.0545912 11.9119235 50.4567017 ] [ -1187.2742983 -431.2646034 180.7682154 ] [ 1094.6318468 -729.8271387 -1026.4903404 ] [ 64.7118397 -7.3772679 -17.825408 ] [ 366.5469734 79.1375463 -53.4779434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.538259237888944e-07 1.726216412483681e-06 1.388396242738568e-06 ] [ 1.130270118306202e-08 1.90850054976955e-08 8.084054849244807e-08 ] [ -1.902223138885006e-06 -6.90962070638757e-07 2.89622610883759e-07 ] [ 1.753793567775227e-06 -1.169311988484217e-06 -1.644618838415586e-06 ] [ 1.036797975104936e-07 -1.181968625213825e-08 -2.855945218911667e-08 ] [ 5.872729960448995e-07 1.267923275539531e-07 -8.568111134985451e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 311.00618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.98286834625598e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1507693 0.2028969 2.342756 ] [ 0.8270433 2.2641707 -0.2975553 ] [ -0.0147134 3.0004339 2.2713382 ] [ 1.8768487 -0.2216609 0.4563936 ] [ 3.8421616 0.8945435 2.0555259 ] [ 2.5604493 3.0778339 3.2853016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.507693e-11 2.028969e-11 2.342756e-10 ] [ 8.270433e-11 2.2641707e-10 -2.975553e-11 ] [ -1.47134e-12 3.0004339e-10 2.2713382e-10 ] [ 1.8768487e-10 -2.216609e-11 4.563936e-11 ] [ 3.8421616e-10 8.945435e-11 2.0555259e-10 ] [ 2.5604493e-10 3.0778339e-10 3.2853016e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.75e-05 -2.92e-05 -8.5e-06 ] [ 1.9e-06 -6.69e-05 -2.43e-05 ] [ -1.3e-05 4.89e-05 1.09e-05 ] [ -1.02e-05 4.95e-05 -1.2e-05 ] [ -2.5e-06 -3.66e-05 -1.82e-05 ] [ 6.4e-06 3.43e-05 5.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8038091095e-14 -4.67835577128e-14 -1.3618501389e-14 ] [ 3.0441356046e-15 -1.071856168146e-13 -3.893289220619999e-14 ] [ -2.082829624199999e-14 7.834643740259999e-14 1.74637253106e-14 ] [ -1.63422016668e-14 7.930774338299999e-14 -1.9226119608e-14 ] [ -4.005441585e-15 -5.86396648044e-14 -2.915961473879999e-14 ] [ 1.02539304576e-14 5.49546585462e-14 8.347340263139999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.470559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.47865681447184e-18 } }