{ "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" [ [ 0.4448584 0.6163604 -0.2633981 ] [ -0.5324167 1.168175 -1.246824 ] [ 0.112956 -0.0102691 0.7320789 ] [ 0.1296152 -0.5027957 -0.4911 ] [ 3.4475532 2.9907427 5.9246414 ] [ -4.1033296 -2.0167103 -3.449016 ] [ -0.6310665 -0.9900312 -1.160508 ] [ 1.13183 -1.2554718 -0.0458743 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.127417339186256e-10 9.875182310028935e-10 -4.220102812599954e-10 ] [ -8.530255962913877e-10 1.87162268942295e-09 -1.997632279510416e-09 ] [ 1.80975463870104e-10 -1.64529120722094e-11 1.172919707824422e-09 ] [ 2.076664448512368e-10 -8.055675222156736e-10 -7.868289449573999e-10 ] [ 5.523589181511929e-09 4.791698072246072e-09 9.492322015909046e-09 ] [ -6.574258806720566e-09 -3.23112612020713e-09 -5.525932845492143e-09 ] [ -1.011080000800161e-09 -1.586204855570981e-09 -1.859338801170072e-09 ] [ 1.81339157966022e-09 -2.011487582605921e-09 -7.349873156110618e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -36.290377 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.814359406845101e-18 } }