{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.51526e-10 0.0 0.0 ] "source-value" [ 5.51526 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] "source-value" [ -0.0933018 5.35906 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] "source-value" [ 0.235006 -0.443739 5.60819 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.851592998891044e-08 1.826641116764626e-08 1.436933907988289e-08 ] [ -1.017284325303534e-08 -9.380551533154179e-09 7.996172559138462e-09 ] [ 1.90011594324501e-09 1.219472542054946e-09 -4.582734467435752e-09 ] [ 1.699355698450418e-08 -1.546549961766498e-08 -1.324521767614993e-08 ] [ -1.304297588261231e-08 -9.299967015875464e-09 -8.286256730047014e-09 ] [ 1.279017996928795e-08 9.499501451359248e-09 1.463937281147044e-08 ] [ 5.753476166698418e-09 7.194229487511266e-09 -9.7339809611193e-09 ] [ 4.294419900604875e-09 -2.033596321659437e-09 -1.156694615739802e-09 ] ] "source-value" [ [ -11.5567346 11.4009972 8.9686361 ] [ -6.3493894 -5.8548798 4.9908184 ] [ 1.1859591 0.7611349 -2.8603179 ] [ 10.6065441 -9.6528057 -8.2670147 ] [ -8.1407853 -5.8045829 -5.1718747 ] [ 7.9830025 5.9291225 9.1371779 ] [ 3.5910374 4.4902849 -6.0754731 ] [ 2.6803661 -1.269271 -0.721952 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.418824589333119e-18 "source-value" -27.580134 } }