{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.35419e-10 0.0 0.0 ] "source-value" [ 5.35419 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] "source-value" [ 0.128546 5.3923 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] "source-value" [ 0.0752915 -0.0875116 5.49588 ] } "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" [ [ -1.850127231587739e-09 8.79757425528549e-10 2.215436158325443e-09 ] [ -9.51946857749597e-10 -7.857282431363904e-11 1.214407741321273e-09 ] [ -4.456044113540275e-10 -2.211565459827253e-09 -3.273262056972298e-09 ] [ 3.88587832058449e-09 -7.064668033111316e-10 1.352888192533893e-09 ] [ -8.766169991341192e-10 3.069640629146516e-10 2.011202699030516e-10 ] [ 1.783901901837619e-09 -1.494205778106626e-09 -8.165944961714265e-10 ] [ -3.013481935322544e-09 1.371501639643699e-09 -1.73696357424869e-09 ] [ 1.467997052508255e-09 1.932587737471749e-09 8.429679255264155e-10 ] ] "source-value" [ [ -1.1547585999999996 0.5491013999999997 1.3827664999999996 ] [ -0.5941584999999998 -0.04904129999999999 0.7579736999999998 ] [ -0.2781243999999999 -1.3803505999999997 -2.0430094999999993 ] [ 2.4253744999999993 -0.44094189999999983 0.8444063999999997 ] [ -0.5471412999999998 0.19159189999999995 0.12552939999999996 ] [ 1.1134239999999995 -0.9326098999999997 -0.5096781999999997 ] [ -1.8808674999999992 0.8560239999999997 -1.0841273999999996 ] [ 0.9162516999999997 1.2062263999999996 0.5261391999999998 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.813755017920439e-18 "source-value" -36.286605 } }