{ "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" [ [ 10.9982119 -12.1422888 4.4428392 ] [ -0.1747138 -2.2178402 0.677882 ] [ 0.9348897 -3.2957515 2.0628627 ] [ 2.6927474 0.0115595 -1.2891778 ] [ -1.4489032 0.9736302 0.806151 ] [ -6.4624083 9.9404962 -5.3116623 ] [ -2.9035239 5.2799036 1.3474183 ] [ -3.6362999 1.450291 -2.7363131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.762107797678435e-08 -1.945409123836168e-08 7.118213096213775e-09 ] [ -2.799223656911271e-10 -3.553371717110396e-09 1.086086692061146e-09 ] [ 1.497858420366726e-09 -5.280376001266532e-09 3.305070389860365e-09 ] [ 4.314256929999986e-09 1.85203606481376e-11 -2.065490531214379e-09 ] [ -2.321398832842307e-09 1.559927543744828e-09 1.291596285034541e-09 ] [ -1.035391949232387e-08 1.592643061079124e-08 -8.510221154644756e-09 ] [ -4.651958110514037e-09 8.459338107997755e-09 2.15880209869808e-09 ] [ -5.825994685997378e-09 2.323622333556653e-09 -4.384056876008772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.818753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.816184919320987e-18 } }