{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5782321 -0.2996553 -1.5957421 ] [ -2.5924551 -0.7270219 2.2438588 ] [ 0.7684627 0.7221972 -2.0346725 ] [ -1.9601242 2.321158 -1.343603 ] [ 0.1000332 -0.7752841 1.9958931 ] [ -0.8287247 -0.667981 1.968496 ] [ 3.7766879 0.3440267 -1.6162622 ] [ 0.1578881 -0.9174395 0.3820319 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.264299520160878e-10 -4.801007159588103e-10 -2.556660685446296e-09 ] [ -4.153570951693726e-09 -1.164817490989596e-09 3.595058109736343e-09 ] [ 1.231212971896844e-09 1.157087469447222e-09 -3.259904710484689e-09 ] [ -3.140465167104304e-09 3.718905080782887e-09 -2.152689314236743e-09 ] [ 1.602708543438106e-10 -1.242142059497969e-09 3.197773262436036e-09 ] [ -1.327763339419494e-09 -1.070223541338605e-09 3.153878269338317e-09 ] [ 6.050921057438249e-09 5.511915356709755e-10 -2.589537509922774e-09 ] [ 2.529646225225325e-10 -1.469900117898442e-09 6.120825785798035e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.421435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.675139503218686e-18 } }