{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48581e-10 0.0 0.0 ] "source-value" [ 5.48581 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] "source-value" [ 0.00228581 5.44331 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] "source-value" [ -0.0206328 -0.0957916 5.42731 ] } "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" [ [ 5.804482420727558e-10 2.075974053497259e-09 -7.667754550182989e-09 ] [ -7.225193793755496e-09 6.631044217874644e-09 7.736194728893702e-10 ] [ 2.600671355696037e-09 -5.095881838592845e-09 2.066648744693555e-09 ] [ -3.020432497938898e-09 -1.006190950511712e-10 1.890958061898179e-09 ] [ -6.579134496449034e-09 -4.541429232627895e-09 3.148669272708772e-09 ] [ 1.219911442318448e-08 4.222969552459002e-09 4.602948969642723e-09 ] [ -2.528544568580863e-09 3.275562942817429e-09 -1.3528856290513e-09 ] [ 3.973071335771019e-09 -6.467620600376424e-09 -3.46220434259831e-09 ] ] "source-value" [ [ 0.3622873 1.2957211 -4.785836 ] [ -4.5096113 4.1387723 0.4828553 ] [ 1.6232114 -3.1805993 1.2899007 ] [ -1.8852057 -0.0628015 1.1802432 ] [ -4.1063728 -2.8345372 1.9652448 ] [ 7.6140884 2.6357703 2.8729348 ] [ -1.5781934 2.0444456 -0.8444048 ] [ 2.4797961 -4.0367713 -2.160938 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.517655855830582e-18 "source-value" -15.713972 } }