{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7885485 0.2792229 -0.4757847 ] [ 0.8923536 1.8792689 0.6105213 ] [ 1.1889212 -0.6796296 0.1962224 ] [ -0.6736507 -0.0132368 -2.0382998 ] [ 0.0697972 -0.4667028 -0.6913228 ] [ 1.3778289 -0.2449196 -0.8337787 ] [ -0.4102048 -1.0384074 2.2405095 ] [ -0.656497 0.2844044 0.9919328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.865570591866909e-09 4.473644023719763e-10 -7.622911228743418e-10 ] [ 1.429708075406715e-09 3.010920695776533e-09 9.78162953360423e-10 ] [ 1.904861750613481e-09 -1.088886655923656e-09 3.143829417572659e-10 ] [ -1.079307402125555e-09 -2.120769149420544e-11 -3.265716285741316e-09 ] [ 1.118274420373018e-10 -7.477403150218982e-10 -1.107621227585994e-09 ] [ 2.207525251042581e-09 -3.924044570956877e-10 -1.335860740061017e-09 ] [ -6.572205402999399e-10 -1.663712059145714e-09 3.589691939580298e-09 ] [ -1.051824145025338e-09 4.556660805326515e-10 1.589251541564682e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.147658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.791493254427409e-18 } }