{ "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" [ 5.45078 0 0 ] "si-unit" "m" "si-value" [ 5.45078e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.124172 5.56718 0 ] "si-unit" "m" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0770044 0.0388551 5.42613 ] "si-unit" "m" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.40624490000000013 0.3970917000000001 1.7343943000000004 ] [ -1.4065114000000003 -0.6483076000000001 0.23898930000000004 ] [ -0.07167290000000001 -0.34133690000000005 -0.5489497000000001 ] [ 1.0522244000000003 0.23924490000000007 -0.13200250000000002 ] [ -1.5290569000000005 -0.47258650000000013 0.07407350000000001 ] [ 1.3003020000000003 -0.33427300000000004 0.19896960000000005 ] [ -0.4273028000000001 0.4203458000000001 -1.1326952000000001 ] [ 1.4882625000000003 0.7398216000000001 -0.4327792000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.508760810992342e-10 6.362110380537276e-10 2.778805998708782e-09 ] [ -2.253479681968678e-09 -1.038703279806958e-09 3.829030690813575e-10 ] [ -1.148326447249364e-10 -5.468820009963476e-10 -8.795143753351739e-10 ] [ 1.685849333515308e-09 3.83312585425634e-10 -2.11491319387152e-10 ] [ -2.449819217052924e-09 -7.571670416056995e-10 1.186788299208288e-10 ] [ 2.083313464379482e-09 -5.355643855646785e-10 3.187844413699278e-10 ] [ -6.846145561623785e-10 6.734682134114728e-10 -1.81477776793238e-09 ] [ 2.384459383113361e-09 1.18532487108285e-09 -6.933887162085275e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.277656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.729491623022485e-18 } }