{ "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" [ [ 0.25607309999999994 5.331452099999999 -2.0285605999999996 ] [ 0.3514536999999999 -8.052694499999998 -0.33732519999999994 ] [ -1.3883177999999998 6.1237395999999995 0.7070813999999999 ] [ -0.5319400999999999 -2.6660839999999997 0.36743289999999995 ] [ -0.9185958999999999 0.40102979999999994 -2.9049752999999994 ] [ -1.3771682999999997 -0.9003840999999999 5.8997307999999995 ] [ 5.937492699999999 4.195386699999999 -4.496950499999999 ] [ -2.3289973999999996 -4.432445499999999 2.7935664999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.102743340357804e-10 8.541927909535063e-09 -3.25011236719602e-09 ] [ 5.630909014336568e-10 -1.290183886234474e-08 -5.404545490466841e-10 ] [ -2.22433032140049e-09 9.811312418987145e-09 1.132869288082533e-09 ] [ -8.52261991886014e-10 -4.271537453888947e-09 5.886924020927442e-10 ] [ -1.471752874942735e-09 6.425205698040998e-10 -4.654283509661465e-09 ] [ -2.20646685316688e-09 -1.442574354760049e-09 9.45241075677368e-09 ] [ 9.512911990110666e-09 6.721750485955262e-09 -7.204908955994868e-09 ] [ -3.731465184183986e-09 -7.101560553070165e-09 4.475786934950083e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.780047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.611071844892518e-18 } }