{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4311342 0.15204 0.5888549 ] [ -5.1624496 3.8478716 4.8390182 ] [ 4.5172206 -6.1525072 -3.1878621 ] [ -0.2550471 0.5093076 0.0455434 ] [ -0.8778051 0.6528942 0.628472 ] [ -3.9059942 4.1339121 4.7935095 ] [ 5.7105624 -2.835847 -5.4262367 ] [ -0.4576211 -0.3076714 -2.2812993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.907531413582828e-10 2.4359493543336e-10 9.434495615964065e-10 ] [ -8.271156123322645e-09 6.164969968152194e-09 7.752961891540738e-09 ] [ 7.237385295943459e-09 -9.857403276356762e-09 -5.107518169034171e-09 ] [ -4.086305041894614e-10 8.160007362386183e-10 7.296857131291559e-11 ] [ -1.406398820426033e-09 1.046051831714123e-09 1.006923153523248e-09 ] [ -6.258092639779522e-09 6.62325737362987e-09 7.680048915757022e-09 ] [ 9.14932964427896e-09 -4.543527800998997e-09 -8.693789651293265e-09 ] [ -7.331898336453773e-10 -4.929439280300675e-10 -3.655044433620556e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.608726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.705146876370827e-18 } }