{ "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" [ 5.35419 0 0 ] "si-unit" "m" "si-value" [ 5.35419e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.128546 5.3923 0 ] "si-unit" "m" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0752915 -0.0875116 5.49588 ] "si-unit" "m" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1737930999999995 0.5417153999999997 1.4675797999999995 ] [ -0.6420242999999998 -0.02931519999999999 0.7676938999999998 ] [ -0.24553629999999993 -1.4908382999999996 -2.098769199999999 ] [ 6.389757799999998 -4.3320672999999985 4.945521599999998 ] [ -0.5283769999999998 0.18181309999999995 0.13832779999999995 ] [ 1.1183796999999995 -0.9401038999999997 -0.5710969999999997 ] [ -5.825465999999998 4.770505299999998 -5.1798034999999985 ] [ 0.9070592999999997 1.2982909999999996 0.5305464999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.880623877970424e-09 8.67923756157963e-10 2.351322064090392e-09 ] [ -1.028636331920206e-09 -4.696812846103678e-11 1.229981228644332e-09 ] [ -3.933925226588141e-10 -2.388586289332281e-09 -3.362598972398871e-09 ] [ 1.023752064407924e-08 -6.940737004975465e-09 7.92359915046229e-09 ] [ -8.465532833430175e-10 2.912967005751053e-10 2.216255689926251e-10 ] [ 1.791841823279929e-09 -1.506212502112272e-09 -9.149982691474975e-10 ] [ -9.33342550736144e-09 7.643192124033156e-09 -8.298960136411416e-09 ] [ 1.453269216112396e-09 2.080091504332493e-09 8.500292055504805e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.881044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.74877703003259e-18 } }