{ "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" [ [ 1.158115746402451e-09 7.873774596627772e-09 4.542701521082471e-09 ] [ 5.189314210193757e-09 -6.616480432391571e-09 -4.98114932990671e-09 ] [ -9.84768006588502e-09 -2.254731302344846e-09 -2.749241674395807e-09 ] [ 3.773461918421382e-09 7.359484392887062e-09 -5.130696976345167e-09 ] [ -3.156060433895846e-10 1.657563546145732e-09 -1.40478766002913e-09 ] [ 3.530368145841936e-09 -3.787839050328131e-09 -6.658060440489897e-09 ] [ -2.046307029662892e-09 -6.546598935592786e-09 7.177655771457401e-09 ] [ -1.441666881922028e-09 2.314827184996771e-09 9.203578628409178e-09 ] ] "source-value" [ [ 0.7228389999999998 4.914423599999998 2.835331299999999 ] [ 3.238915199999999 -4.129682299999998 -3.108988899999999 ] [ -6.146438499999999 -1.4072925999999994 -1.7159416999999992 ] [ 2.355209699999999 4.593428899999998 -3.202329199999999 ] [ -0.19698579999999993 1.0345697999999997 -0.8767994999999996 ] [ 2.203482499999999 -2.364183199999999 -4.155634499999998 ] [ -1.2772043999999996 -4.086065699999998 4.4799403999999985 ] [ -0.8998176999999997 1.4448014999999996 5.744421999999998 ] ] } "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" -2.920377369058249e-18 "source-value" -18.227562 } }