{ "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" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 553.2702396999999 -479.93927189999994 803.7943426999999 ] [ -23.677148499999998 16.784283599999995 -14.557897199999998 ] [ -3.4847134999999994 -2.1284911999999996 -1.5091408999999998 ] [ -76.79678079999998 -77.88146089999998 112.00066289999998 ] [ 89.66003879999998 67.31621229999999 -89.09968099999999 ] [ -555.2768699999999 475.4385315999999 -794.0974027999999 ] [ -55.47171169999999 -76.02618759999999 -67.03264709999999 ] [ 71.77694599999998 76.43638399999999 50.501763399999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.864366430317519e-07 -7.689474808419543e-07 1.287820503805243e-06 ] [ -3.793497377390979e-08 2.689138678079685e-08 -2.332432254184978e-08 ] [ -5.58312649988614e-09 -3.410218838218537e-09 -2.41791026747307e-09 ] [ -1.230420067504623e-07 -1.247798558477293e-07 1.794448436124819e-07 ] [ 1.436512179853808e-07 1.078524615478694e-07 -1.42753425818938e-07 ] [ -8.896516191850009e-07 7.617364999570019e-07 -1.27228429340416e-06 ] [ -8.887547960149781e-08 -1.218073803412748e-07 -1.073981400139569e-07 ] [ 1.149993447936241e-07 1.224645874232912e-07 8.091274462865311e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 210.17914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.367441042878501e-17 } }