{ "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" [ [ -3.873071699999999 2.129475699999999 3.5369828999999986 ] [ -1.6352755999999995 -0.14345499999999994 2.130578499999999 ] [ -2.098291399999999 -4.129670699999998 -5.201391599999998 ] [ 7.818268699999997 -1.0517249999999996 2.153749799999999 ] [ -1.1627645999999996 0.2807507999999999 0.21063389999999993 ] [ 3.052825599999999 -2.736451699999999 -1.5747693999999997 ] [ -5.5820216999999985 2.445621799999999 -2.837858699999999 ] [ 3.480330699999999 3.205454099999999 1.5820744999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.205344979546656e-09 3.411796209210792e-09 5.666871357237556e-09 ] [ -2.620000356470329e-09 -2.298402490304699e-10 3.413563089602767e-09 ] [ -3.361833452403145e-09 -6.61646190165442e-09 -8.33354808580387e-09 ] [ 1.252624742947355e-08 -1.685049220393649e-09 3.450687605042172e-09 ] [ -1.862954272962355e-09 4.49812371736807e-10 3.374727129082925e-10 ] [ 4.891165843997028e-09 -4.384278973809576e-09 -2.523058736618199e-09 ] [ -8.943384738220955e-09 3.91831810356102e-09 -4.546750899733614e-09 ] [ 5.576104526132861e-09 5.135703660379497e-09 2.534762797147232e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.120591 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.626939027247068e-18 } }