{ "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" [ [ 19.045997799999995 -15.575670999999998 26.821705399999995 ] [ -1.6916899999999997 2.4759573999999995 -1.0580762999999997 ] [ -3.9062484999999993 -5.805770599999999 6.663487999999999 ] [ -0.6614639999999999 -7.8452779999999995 12.138034399999999 ] [ 4.197713599999999 4.174544599999999 -2.5483874999999996 ] [ -15.204414399999997 22.817475499999997 -35.22729429999999 ] [ -7.542797299999999 -1.8426256999999997 -10.738364499999998 ] [ 5.762902899999999 1.6013677999999998 3.9488947999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.051505264637539e-08 -2.495497613507141e-08 4.297310967591161e-08 ] [ -2.710386189971459e-09 3.96692109305939e-09 -1.695225124849174e-09 ] [ -6.258500073297547e-09 -9.301869997684158e-09 1.067608477453939e-08 ] [ -1.059782165032176e-09 -1.256952109883425e-08 1.944727509836821e-08 ] [ 6.725478646144021e-09 6.688357815710875e-09 -4.082966906877674e-09 ] [ -2.436015748533312e-08 3.655762609296746e-08 -5.644034780650136e-08 ] [ -1.208489358905829e-08 -2.952211841747893e-09 -1.720475668927509e-08 ] [ 9.233188370390838e-09 2.565674071599984e-09 6.326826978684102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.971597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.879367278906449e-18 } }