{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6240142999999999 1.1727043999999998 -0.8189813999999999 ] [ 0.27611669999999994 -2.1083360999999994 -0.4437461999999999 ] [ -1.0577254999999999 1.1608047999999997 0.13049019999999997 ] [ 1.1152371999999997 -0.18103159999999996 0.20095129999999997 ] [ -0.4795036999999999 -0.5645921999999999 -0.19589319999999996 ] [ -0.24343499999999998 0.6144694999999999 2.3593185999999995 ] [ 2.0064956999999994 0.6539449999999999 -1.2306561999999999 ] [ -0.9931709999999999 -0.7479636999999999 -0.0014829999999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.997811225048773e-10 1.878879572789291e-09 -1.312152851950053e-09 ] [ 4.423877213524473e-10 -3.37792680820865e-09 -7.109597872088408e-10 ] [ -1.69466306732399e-09 1.859814311872419e-09 2.090683476835161e-10 ] [ 1.786806968486453e-09 -2.900445971460172e-10 3.21959474779367e-10 ] [ -7.682496177270969e-10 -9.045764231260376e-10 -3.138555052136985e-10 ] [ -3.90025865684448e-10 9.844886670946655e-10 3.780045101938586e-09 ] [ 3.21476050027573e-09 1.047735390289056e-09 -1.971728591882569e-09 ] [ -1.591235356656557e-09 -1.198369953347065e-09 -2.376027928646399e-12 ] ] } "unrelaxed-potential-energy" { "source-value" 155.98995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.499234509697609e-17 } }