{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46308e-10 0.0 0.0 ] "source-value" [ 5.46308 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] "source-value" [ -0.0404011 5.38219 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] "source-value" [ 0.0107061 -0.144189 5.56456 ] } "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" [ [ 1.036967161220659e-09 9.6234738728352e-11 8.070362308870579e-10 ] [ -3.322228740163159e-09 1.413358503862099e-10 2.47544218687873e-09 ] [ 2.109044741344854e-09 -4.601131620701751e-09 6.393080454617338e-10 ] [ -7.19591353535739e-10 1.106034592078416e-09 1.053407095526688e-10 ] [ -1.250900998866221e-09 1.096769044462668e-09 9.858960190383762e-10 ] [ -8.745537160818527e-10 1.864945282500532e-09 1.628646180752237e-09 ] [ 4.085576979171906e-09 6.278902939912646e-10 -2.740552269492899e-09 ] [ -1.064314073090446e-09 -3.320781814456915e-10 -3.901116942860242e-09 ] ] "source-value" [ [ 0.647224 0.060065 0.5037124 ] [ -2.0735721 0.0882149 1.5450495 ] [ 1.3163622 -2.8718005 0.3990247 ] [ -0.4491336 0.6903325 0.0657485 ] [ -0.780751 0.6845494 0.6153479 ] [ -0.5458535 1.1640073 1.016521 ] [ 2.5500166 0.3918983 -1.7105182 ] [ -0.6642926 -0.2072669 -2.4348857 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.771525487420041e-18 "source-value" -36.023029 } }