{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.21631e-10 0.0 0.0 ] "source-value" [ 5.21631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] "source-value" [ 0.340777 5.491 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] "source-value" [ 0.0764414 0.261433 5.31631 ] } "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" [ [ 2.352665950467867e-09 -2.007096961222053e-09 2.778696570045581e-10 ] [ 6.626838023592058e-10 -1.268975633978452e-09 1.306117132184175e-09 ] [ 2.970118223992281e-10 -1.277587813968238e-09 4.751881220041132e-10 ] [ 6.925341151989927e-10 4.976775547949587e-10 -4.494470717613543e-10 ] [ -9.060686904306509e-10 7.974617836188193e-10 -3.958001102258113e-11 ] [ -1.681609333306022e-09 2.057413798651263e-09 -1.063444091185352e-09 ] [ -1.461457448195136e-10 1.104393482565731e-09 -3.89110702398647e-10 ] [ -1.271071761651444e-09 9.671394975563328e-11 -1.175928746072506e-10 ] ] "source-value" [ [ 1.4684186 -1.2527314 0.1734326 ] [ 0.4136147 -0.7920323 0.8152142 ] [ 0.1853802 -0.7974076 0.2965891 ] [ 0.4322458 0.3106259 -0.2805228 ] [ -0.5655236 0.4977365 -0.0247039 ] [ -1.049578 1.2841367 -0.6637496 ] [ -0.091217 0.6893082 -0.2428638 ] [ -0.7933406 0.0603641 -0.0733957 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.549291413572763e-18 "source-value" 34.635953 } }