{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1379913999999998 2.6751372999999994 -1.2094655999999997 ] [ 0.5572219999999999 -1.1443453999999997 -0.6659680999999998 ] [ -0.5832820999999999 1.9319987999999995 0.6119526999999999 ] [ -0.28973669999999996 -1.5451967999999996 0.33657049999999994 ] [ -0.6185629999999999 0.33390429999999993 -0.10523969999999998 ] [ 1.4297129999999998 -1.5105801999999995 0.34915399999999996 ] [ -2.3839528999999997 0.20362809999999995 -1.2284418999999998 ] [ 0.7506081999999997 -0.9445460999999998 1.9114380999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.823263215751461e-09 4.286042439490035e-09 -1.937777507981844e-09 ] [ 8.927680609954174e-10 -1.833443446000024e-09 -1.066998520018596e-09 ] [ -9.345209439511275e-10 3.095403308773654e-09 9.80456308975436e-10 ] [ -4.642093669277433e-10 -2.475678187494973e-09 5.392453863509663e-10 ] [ -9.910471770919101e-10 5.349736630445893e-10 -1.686125869200057e-10 ] [ 2.29065274305383e-09 -2.420216280283387e-09 5.594063758588031e-10 ] [ -3.81951360146836e-09 3.262481811579244e-10 -1.968180892191131e-09 ] [ 1.20260690942077e-09 -1.513329678687819e-09 3.062461435926372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.344573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.662824853275892e-18 } }