{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] "source-value" [ 5.4207 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] "source-value" [ -0.121917 5.37017 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] "source-value" [ -0.0328689 -0.300504 5.4102 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.618216431097651e-10 8.073605114351079e-10 -6.924448739612141e-10 ] [ 1.606813319940595e-10 -1.633866072182803e-09 -3.42034587620329e-10 ] [ -7.566572290049607e-10 9.129775964548646e-10 6.720794467165633e-11 ] [ 8.625888212953806e-10 -2.397143014331923e-10 2.44013421959785e-10 ] [ -1.926365844782535e-10 -3.233971078612109e-10 -8.629339301395009e-11 ] [ -3.455862927533184e-10 4.142765712345389e-10 1.741509269757223e-09 ] [ 1.530084440699835e-09 5.905075079864487e-10 -9.378502669691503e-10 ] [ -7.966526844253152e-10 -5.281447056337536e-10 5.892485175978241e-12 ] ] "source-value" [ [ -0.28824639999999996 0.5039147999999999 -0.43219009999999997 ] [ 0.10028939999999999 -1.0197789999999998 -0.21348119999999998 ] [ -0.4722682999999999 0.5698357999999999 0.041947899999999996 ] [ 0.5383855999999999 -0.14961789999999997 0.15230119999999997 ] [ -0.12023429999999999 -0.20184859999999996 -0.053860099999999994 ] [ -0.21569799999999997 0.25857109999999994 1.0869645999999997 ] [ 0.9550035999999998 0.36856579999999994 -0.5853600999999999 ] [ -0.49723149999999994 -0.32964199999999994 0.0036777999999999997 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.131297792577968e-18 "source-value" 32.027042 } }