{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37928e-10 0.0 0.0 ] "source-value" [ 5.37928 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] "source-value" [ -0.109609 5.36452 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] "source-value" [ -0.116688 0.583163 5.41925 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.94933831365583e-08 -2.237405220171619e-08 3.003053271567159e-08 ] [ -3.575099314918051e-09 4.97227887904565e-09 -8.012147221353811e-10 ] [ -1.71799316218777e-10 -2.773532274143756e-09 1.930265062024576e-09 ] [ -7.393030126102724e-09 -4.968751687214958e-09 1.303508035622501e-08 ] [ 8.550820310215828e-09 7.90749640905406e-09 5.233982573946336e-10 ] [ -2.929488514913051e-08 2.674735286498123e-08 -4.061875531810957e-08 ] [ -3.252167318929859e-09 -9.030420986851288e-09 -1.176886318973459e-08 ] [ 5.642777618308131e-09 -4.803711633724013e-10 7.669556838663728e-09 ] ] "source-value" [ [ 18.408321999999995 -13.964785099999999 18.743584399999996 ] [ -2.2314014999999996 3.1034523999999997 -0.5000788999999999 ] [ -0.10722869999999998 -1.7311026999999999 1.2047766999999998 ] [ -4.614366499999999 -3.1012508999999997 8.135857299999998 ] [ 5.337002299999999 4.935471099999999 0.32667949999999996 ] [ -18.284429299999996 16.694384699999997 -25.352233199999997 ] [ -2.0298431999999997 -5.636345499999999 -7.345546699999999 ] [ 3.5219447999999995 -0.2998240999999999 4.7869608999999995 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.964749009700657e-18 "source-value" -18.504508 } }