{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0551698 1.8464827 -0.5529066 ] [ -1.0232112 0.6143561 -0.3495331 ] [ 1.6063367 1.7690188 -1.6686757 ] [ -0.5062865 0.9385695 -2.6140252 ] [ 0.3747634 -1.1182402 1.4541189 ] [ -1.569378 -1.5230235 2.3485461 ] [ 2.5357013 -1.2898793 1.107472 ] [ -1.4730955 -1.2372841 0.2750037 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.839176446245319e-11 2.958391437025231e-09 -8.858540353043845e-10 ] [ -1.639365076287101e-09 9.843069883753674e-10 -5.600137656295853e-10 ] [ 2.573635127076667e-09 2.834280586466719e-09 -2.673513216263593e-09 ] [ -8.111604004096409e-10 1.503754122285063e-09 -4.188130096127177e-09 ] [ 6.004371627583956e-10 -1.791618319639487e-09 2.329755324637782e-09 ] [ -2.514420761513652e-09 -2.440152664732899e-09 3.762785685291827e-09 ] [ 4.062641373663423e-09 -2.066614475140276e-09 1.774365761209248e-09 ] [ -2.360159189750546e-09 -1.982347674639719e-09 4.406045024035458e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.766769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.730468156547554e-18 } }