{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1150059 0.1435011 -0.4589316 ] [ -0.1185859 0.9861647 -0.3839709 ] [ -0.3205763 0.0108554 0.3931626 ] [ 0.5237674 -0.4066753 -0.1161565 ] [ 0.0411684 0.4179147 1.6499986 ] [ -0.6183124 0.1210423 -0.479327 ] [ -0.3410384 -0.8954261 -0.9059551 ] [ 0.7185712 -0.3773768 0.30118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.842597642340627e-10 2.299141074790829e-10 -7.352894800663373e-10 ] [ -1.899955565365267e-10 1.580010026598246e-09 -6.151891990475347e-10 ] [ -5.13619853042567e-10 1.739226808943232e-11 6.299159258929421e-10 ] [ 8.39167883017202e-10 -6.515656579168263e-10 -1.861032286539552e-10 ] [ 6.595904799574272e-11 6.695731618286458e-10 2.643589181272731e-09 ] [ -9.906456716307378e-10 1.939311431878599e-10 -7.679665131182016e-10 ] [ -5.464037512750388e-10 -1.434630763074123e-09 -1.451500080714526e-09 ] [ 1.151277977020201e-09 -6.046242861923175e-10 4.82543554652544e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 645.55412 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.034291718525118e-16 } }