{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2687889 0.0900827 -3.0401663 ] [ 1.8854048 3.4920847 -1.5285256 ] [ 0.969223 -0.185544 0.7217203 ] [ 4.1448395 -3.3097569 3.9665594 ] [ 3.2627708 1.8489623 5.5773688 ] [ -2.9794959 -4.8046791 -4.3881255 ] [ -7.1046335 2.8853634 -2.447129 ] [ -1.4468975 -0.0165131 1.138298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.032823929058563e-09 1.443283970676318e-10 -4.870883409334234e-09 ] [ 3.020751516191443e-09 5.5949365102889e-09 -2.44896800079083e-09 ] [ 1.552866443735382e-09 -2.97274261378896e-10 1.15632340094347e-09 ] [ 6.640764998580242e-09 -5.302815169400274e-09 6.355128788053059e-09 ] [ 5.227535137857487e-09 2.962364194206898e-09 8.93592997056062e-09 ] [ -4.773678712078799e-09 -7.69794458788815e-09 -7.030552143159567e-09 ] [ -1.138287778683364e-08 4.622861820078795e-09 -3.920732904183785e-09 ] [ -2.318185366293015e-09 -2.64569029749054e-11 1.823754458128932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.463031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.681803963901765e-18 } }