{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37928e-10 0.0 0.0 ] "source-value" [ 5.37928 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] "source-value" [ -0.109609 5.36452 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] "source-value" [ -0.116688 0.583163 5.41925 ] } "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" [ [ 3.194814538892171e-08 -2.627584269962782e-08 4.250081344909687e-08 ] [ -3.105760739756479e-09 4.172545849849185e-09 -1.4524254979307e-09 ] [ -8.775207869659124e-10 -2.45257111561681e-09 1.974525351391838e-09 ] [ -5.883732324881148e-09 -8.679595736765613e-09 1.208322434188982e-08 ] [ 6.701640766099293e-09 6.692832319473458e-09 -4.102301780481112e-09 ] [ -3.548965058489015e-08 3.662518701639333e-08 -4.275224526924628e-08 ] [ -2.269120610793913e-09 -1.293720258537203e-08 -1.474736191897729e-08 ] [ 8.975999052484263e-09 2.854646951666295e-09 6.495771324256865e-09 ] ] "source-value" [ [ 19.940464099999996 -16.400091199999995 26.526921499999997 ] [ -1.9384633999999998 2.6042982999999995 -0.9065326999999999 ] [ -0.5477053999999999 -1.5307744999999997 1.2324017999999999 ] [ -3.6723368999999995 -5.417377599999999 7.541755499999999 ] [ 4.1828351999999995 4.177337399999999 -2.5604553999999995 ] [ -22.150897799999996 22.859643899999995 -26.683852899999998 ] [ -1.4162736999999999 -8.074766799999999 -9.204579399999998 ] [ 5.602377999999999 1.7817304999999999 4.054341599999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.084039550655307e-18 "source-value" -19.249061 } }