{ "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" [ [ -3.4564822 0.18438 -0.2586344 ] [ 1.7526314 2.7763447 0.6399398 ] [ 2.3711561 -1.4301986 0.075061 ] [ -0.1758578 0.2345507 -3.4438224 ] [ -0.4988232 -0.5885697 -1.1026699 ] [ 2.2724423 0.5461453 -2.4448401 ] [ -1.3896362 -1.9315239 4.2148646 ] [ -0.8754301 0.2088716 2.3201014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.53789497105135e-09 2.95409325343104e-10 -4.143779890146355e-10 ] [ 2.808025053959973e-09 4.44819456962199e-09 1.025296586279428e-09 ] [ 3.799010867687307e-09 -2.291430760020891e-09 1.202609793338688e-10 ] [ -2.817552557453223e-10 3.757916479322746e-10 -5.517611735467346e-09 ] [ -7.992028689526427e-10 -9.429926130512696e-10 -1.766671934239874e-09 ] [ 3.640853925176979e-09 8.750212312198022e-10 -3.917065649814334e-09 ] [ -2.226442631057353e-09 -3.094642435096437e-09 6.752957521957545e-09 ] [ -1.402593639364606e-09 3.346491942690893e-10 3.717212220965349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.333744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.661089856213228e-18 } }