{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2020357 2.1100568 -0.5956119 ] [ -0.4973461 -0.4109319 -0.4736256 ] [ 0.2635987 0.162848 -0.4755741 ] [ -0.1220674 -0.1316665 -0.8610202 ] [ 0.865562 -0.0583558 0.2804094 ] [ 0.4199366 -2.0083626 -1.1048771 ] [ -0.41266 0.8263218 1.6488742 ] [ -1.7190594 -0.4899098 1.5814254 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.925873495906962e-09 3.380683673520062e-09 -9.542754612502675e-10 ] [ -7.968362938660589e-10 -6.583854829209236e-10 -7.588318633323725e-10 ] [ 4.22331674413273e-10 2.609112583440384e-10 -7.619537044780013e-10 ] [ -1.955735344418419e-10 -2.109529880425632e-10 -1.37950643447654e-09 ] [ 1.38678320025289e-09 -9.349629844808064e-11 4.492653849325555e-10 ] [ 6.728126027382413e-10 -3.217751603809102e-09 -1.770208258477304e-09 ] [ -6.611542043393281e-10 1.323913469217373e-09 2.641787693880304e-09 ] [ -2.754236780446475e-09 -7.849220278608039e-10 2.533722803419289e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.101379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.541031272124009e-18 } }