{ "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" [ [ -1.59065793220242e-09 5.075504875676525e-10 1.519089663857257e-09 ] [ -5.430965382943835e-10 -5.083353938941824e-11 1.252167519484963e-09 ] [ -2.678382689640672e-10 -1.791682071508224e-09 -3.004449023752136e-09 ] [ 3.387687748835551e-09 -9.2568141509885e-10 1.768893191906951e-09 ] [ -9.914310586102542e-10 2.963099088216557e-10 -9.746072427858816e-11 ] [ 1.682762419820012e-09 -1.118623374441028e-09 -2.875772451499853e-10 ] [ -2.885992415728612e-09 1.424272370785327e-09 -2.060630488652843e-09 ] [ 1.208566205361836e-09 1.658687633262885e-09 9.099671065843816e-10 ] ] "source-value" [ [ -0.9928105999999997 0.3167880999999999 0.9481411999999997 ] [ -0.3389741999999999 -0.03172779999999999 0.7815414999999998 ] [ -0.16717149999999995 -1.1182799999999995 -1.8752295999999993 ] [ 2.114428399999999 -0.5777648999999998 1.1040562999999997 ] [ -0.6188025999999998 0.18494209999999994 -0.06083019999999998 ] [ 1.0502976999999996 -0.6981897999999997 -0.17949159999999995 ] [ -1.8012947999999993 0.8889608999999997 -1.2861443999999995 ] [ 0.7543276999999998 1.0352713999999996 0.5679567999999998 ] ] } "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" -4.376754635624153e-18 "source-value" -27.317554 } }