{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5071888 -0.4046451 -0.0113836 ] [ 0.913001 0.802565 0.8757896 ] [ 0.6905179 -0.6894463 1.3077392 ] [ -1.9532433 1.2358506 -1.9789184 ] [ -0.5752088 -0.2583389 0.1992008 ] [ -1.0874576 0.5181651 -0.6350878 ] [ 2.4583154 -0.5655928 0.773713 ] [ -0.9531134 -0.6385577 -0.5310527 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.12606037691607e-10 -6.483129189412781e-10 -1.823853778053888e-11 ] [ 1.462788856967021e-09 1.285850879672352e-09 1.403169621859783e-09 ] [ 1.106331635623912e-09 -1.104614743157063e-09 2.095229172343695e-09 ] [ -3.129440749994241e-09 1.980050938121652e-09 -3.170576794950943e-09 ] [ -9.21586091438423e-10 -4.139045458231891e-10 3.191548646046567e-10 ] [ -1.742299142831278e-09 8.301920089344941e-10 -1.017522825315306e-09 ] [ 3.9386554604326e-09 -9.061795610528103e-10 1.23962487980903e-09 ] [ -1.527056006451199e-09 -1.02308221797182e-09 -8.508402203527163e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 153.2178 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.454819770504103e-17 } }