{ "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" [ [ 59.405116099999994 -51.19775679999999 73.86429629999999 ] [ -6.298241999999999 6.679185399999999 -2.4630122999999995 ] [ 1.0318986999999997 -1.8695855999999997 1.2861629999999997 ] [ -13.363165999999998 -10.862855299999998 18.819803699999998 ] [ 14.614558399999998 11.832492799999999 -6.400811599999999 ] [ -59.49909889999999 50.69619449999999 -77.14305089999999 ] [ -6.576411199999999 -13.250835799999999 -16.203290699999997 ] [ 10.685344899999999 7.973160899999999 8.239902399999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.517748817132967e-08 -8.202784898236421e-08 1.183436486437039e-07 ] [ -1.009089608454063e-08 1.070123469386869e-08 -3.946180723802835e-09 ] [ 1.653283972173913e-09 -2.99540633890434e-09 2.06066028913799e-09 ] [ -2.141015214506945e-08 -1.740421279679337e-08 3.015264949618533e-08 ] [ 2.341510379179625e-08 1.895774332994433e-08 -1.025523069966544e-08 ] [ -9.532806521624698e-08 8.122425759142954e-08 -1.235967926091644e-07 ] [ -1.053657227340727e-08 -2.123017932481966e-08 -2.596053353956606e-08 ] [ 1.711980978396451e-08 1.277441198785669e-08 1.320177898295381e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3022451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.086426653771358e-19 } }