{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43182e-10 0.0 0.0 ] "source-value" [ 5.43182 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] "source-value" [ -0.00436542 5.42411 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] "source-value" [ 0.250705 -0.013062 5.36378 ] } "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" [ [ -7.64448229389522e-09 3.739262817579758e-09 -4.1021729654808e-10 ] [ -3.213922722120714e-09 -6.152731050371661e-09 1.131334723315131e-08 ] [ 2.389824431745771e-09 6.222770201349932e-09 -8.943397321733575e-09 ] [ 7.48752682363283e-09 -3.811046899115743e-09 -3.632636521506559e-09 ] [ -1.4272913521919e-09 2.171310291576666e-09 1.400386480851792e-09 ] [ -8.180696682514958e-09 -6.787251952308105e-09 8.535187552491358e-09 ] [ -3.475898146176288e-10 -1.135163925438843e-09 -1.86256433588966e-08 ] [ 1.093663177017948e-08 5.752850676945657e-09 1.036297323219035e-08 ] ] "source-value" [ [ -4.7713106 2.3338643 -0.2560375 ] [ -2.0059728 -3.8402327 7.061236 ] [ 1.4916111 3.8839477 -5.5820296 ] [ 4.6733467 -2.3786684 -2.2673134 ] [ -0.8908452 1.3552253 0.8740525 ] [ -5.1059893 -4.2362695 5.3272451 ] [ -0.2169485 -0.7085136 -11.6252123 ] [ 6.8261087 3.590647 6.4680592 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.492257130225524e-18 "source-value" -34.279973 } }