{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3969183 0.4945426 -0.1527696 ] [ -0.3995331 0.8773228 -1.0053915 ] [ 0.1297331 0.0087207 0.6591501 ] [ 0.0703529 -0.417991 -0.4549757 ] [ 0.6798275 0.5221046 2.549583 ] [ -1.218844 0.2553156 -0.6793715 ] [ -0.431488 -0.7782588 -0.8603603 ] [ 0.7730334 -0.9617565 -0.0558644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.359332206276806e-10 7.923445917096461e-10 -2.447638814889677e-10 ] [ -6.401225920557485e-10 1.405626079054794e-09 -1.610814756051043e-09 ] [ 2.078553397639085e-10 1.397210165701056e-11 1.056074879817982e-09 ] [ 1.127177715854803e-10 -6.696954079048127e-10 -7.289514295721145e-10 ] [ 1.089203726676912e-09 8.365037837321358e-10 4.084882275389126e-09 ] [ -1.952803361202355e-09 4.090606852455245e-10 -1.088473134137827e-09 ] [ -6.913199857557503e-10 -1.246908054291863e-09 -1.378449158124474e-09 ] [ 1.238536040577535e-09 -1.540903779202435e-09 -8.950463561501952e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -25.944264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.156729322466309e-18 } }