{ "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" [ [ 29.8956062 -37.1283039 10.7091346 ] [ 0.7651305 -2.9053113 0.5280282 ] [ 0.3801452 -3.6335589 3.2468621 ] [ 2.2205753 -0.0437566 -2.8609906 ] [ -1.1995844 1.717788 1.8044407 ] [ -21.80484 32.1195081 -13.0812214 ] [ -5.6643964 8.8468915 2.8292141 ] [ -4.5926364 1.0267431 -3.1754677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.789804131828353e-08 -5.948610047853746e-08 1.715792508512036e-08 ] [ 1.225874198961014e-09 -4.654821841006056e-09 8.459944371631065e-10 ] [ 6.090597519493402e-10 -5.821603119879766e-09 5.202046547581592e-09 ] [ 3.557753830385946e-09 -7.010580152569728e-11 -4.583812251648565e-09 ] [ -1.921946080356396e-09 2.752199773090791e-09 2.891032703159987e-09 ] [ -3.493520486828467e-08 5.146112494941623e-08 -2.095842709858865e-08 ] [ -9.075363483023687e-09 1.417428272805424e-08 4.532900686257713e-09 ] [ -7.358214667915077e-09 1.645023790387717e-09 -5.087660109045548e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.58797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.657685772053178e-18 } }