{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.3008697 -12.2300013 3.7752047 ] [ -0.044581 -2.0074205 0.7253196 ] [ 0.6219017 -2.9698057 2.4447559 ] [ 2.4787989 -0.2095215 -1.5518171 ] [ -1.31251 1.521764 1.0386178 ] [ -5.9367741 9.5384177 -5.0182982 ] [ -2.7098728 5.2018413 1.3133668 ] [ -3.3978324 1.1547259 -2.7271495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.650381260724711e-08 -1.959462215521361e-08 6.048544709074279e-09 ] [ -7.142663593188481e-11 -3.216242193214646e-09 1.162090105728008e-09 ] [ 9.963963641757754e-10 -4.758153260858579e-09 3.916930746542863e-09 ] [ 3.971473645244757e-09 -3.356904488549472e-10 -2.486285077377656e-09 ] [ -2.102872836566208e-09 2.438134703175091e-09 1.66404915710673e-09 ] [ -9.511760665990961e-09 1.528222983836491e-08 -8.040200052242723e-09 ] [ -4.341694845501834e-09 8.33426851597188e-09 2.10424558149491e-09 ] [ -5.443927632676753e-09 1.850074840412239e-09 -4.36937517032641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.637422240654235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.429969494754168e-19 } }