{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8985721999999998 1.8571091999999996 -0.9228740999999998 ] [ 0.34754399999999996 -0.6920108999999999 -0.5550018999999999 ] [ -0.7737792999999997 1.8133016999999996 0.07645289999999999 ] [ -0.27080229999999994 -1.0732050999999998 0.35223429999999994 ] [ -0.5299931999999999 0.12893709999999997 -0.049677699999999984 ] [ 1.0473244999999998 -1.1025924999999999 0.35498419999999997 ] [ -1.7271230999999996 0.24711339999999996 -1.0224833999999998 ] [ 1.0082572999999997 -1.1786527999999998 1.7663657999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.439671370940822e-09 2.975416942512591e-09 -1.478607306961841e-09 ] [ 5.568268714993153e-10 -1.108723685318767e-09 -8.892110686795794e-10 ] [ -1.239731104118989e-09 2.905229590196895e-09 1.224910489723603e-10 ] [ -4.338731139188678e-10 -1.719464120543326e-09 5.643415605038533e-10 ] [ -8.491427142229785e-10 2.065800071737516e-10 -7.959244951511613e-11 ] [ 1.677998828291049e-09 -1.766547925769424e-09 5.687473859933912e-10 ] [ -2.76715625206362e-09 3.959193121663986e-10 -1.638198998636094e-09 ] [ 1.615406273810932e-09 -1.888409960200458e-09 2.830029988540688e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.149495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.79178757427265e-18 } }