{ "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" [ [ 1.0391363999999998 9.036440999999998 -2.6220515999999994 ] [ -1.1761004999999998 -11.229397999999998 -0.7169582999999999 ] [ -2.0367074999999994 6.688832599999999 1.1444627999999997 ] [ -0.17942529999999998 -3.0431394999999997 0.23930209999999996 ] [ -1.8484305999999997 -0.29310759999999997 -3.4645013999999996 ] [ 0.7376507999999999 -1.9251712999999997 7.049926699999999 ] [ 6.1822042999999995 5.692818699999999 -6.814975399999999 ] [ -2.7183274999999996 -4.927275899999999 5.184795099999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.664880045902277e-09 1.447797450543857e-08 -4.200989772051232e-09 ] [ -1.88432072481119e-09 -1.799147894125828e-08 -1.148693826348513e-09 ] [ -3.263165139908015e-09 1.071669121216488e-08 1.833631541535306e-09 ] [ -2.874710208400262e-10 -4.875646960733002e-09 3.834042299283436e-10 ] [ -2.961512292491316e-09 -4.69610144098798e-10 -5.550743145808868e-09 ] [ 1.181846866074417e-09 -3.084464447895142e-09 1.129522773709369e-08 ] [ 9.904983194469229e-09 9.120901027593049e-09 -1.091879425720713e-08 ] [ -4.355240768177711e-09 -7.894366251211277e-09 8.306957492858396e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.271684 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.048970127304543e-18 } }