{ "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" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 22.638217599999997 -17.728956499999995 27.434356199999996 ] [ -2.7541071999999995 3.3068455999999995 -0.9258341999999999 ] [ 0.29153029999999996 -1.8917461999999998 1.7034740999999998 ] [ -4.714844099999999 -5.010456499999999 7.808830899999999 ] [ 5.233638699999999 4.676746099999999 -1.9891328999999998 ] [ -23.154826699999997 21.787078999999995 -29.352411399999998 ] [ -2.8666129999999996 -7.356642699999999 -8.880371399999998 ] [ 5.327004299999999 2.2171311999999994 4.201088699999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.627042327412755e-08 -2.840491984950241e-08 4.395468447247302e-08 ] [ -4.412566203371163e-09 5.298150752565709e-09 -1.483349922198082e-09 ] [ 4.6708303476301e-10 -3.03091155909829e-09 2.729266399644179e-09 ] [ -7.554013049972757e-09 -8.027636329973418e-09 1.251112640683719e-08 ] [ 8.385213635938134e-09 7.492973324570625e-09 -3.186942254300658e-09 ] [ -3.709812230305931e-08 3.490674889691208e-08 -4.702774769663522e-08 ] [ -4.592820367320642e-09 -1.178664103862667e-08 -1.422792355832186e-08 ] [ 8.534801818677523e-09 3.552235803152379e-09 6.730886152501433e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.78285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.00934433899269e-18 } }