{ "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" [ 5.44714 0 0 ] "si-unit" "m" "si-value" [ 5.44714e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103058 5.37075 0 ] "si-unit" "m" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0454409 0.00880856 5.43207 ] "si-unit" "m" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.007219700000000002 0.2889495000000001 -0.32242820000000005 ] [ 1.0409600000000003 -1.0029289000000001 -1.4840865000000003 ] [ -0.8958875000000002 0.8536522000000002 1.3739232000000001 ] [ 0.20875780000000005 -1.0340693000000003 0.3900164000000001 ] [ -0.27980740000000004 -0.049262000000000014 0.4967129000000001 ] [ -0.23033420000000004 0.4307511000000001 1.2637053000000003 ] [ 0.08822210000000001 0.4326801000000001 -1.3696418000000001 ] [ 0.060869500000000014 0.08022730000000002 -0.34820130000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.156723454918976e-11 4.629481334918497e-10 -5.165869239266267e-10 ] [ 1.667801775187969e-09 -1.606869235904661e-09 -2.3777686935449e-09 ] [ -1.43537000736696e-09 1.367701597134486e-09 2.201267629814723e-09 ] [ 3.344668665696423e-10 -1.656761656747022e-09 6.248751578085813e-10 ] [ -4.48300874606834e-10 -7.892642469384963e-11 7.958217956297686e-10 ] [ -3.690360702106714e-10 6.90139341803883e-10 2.024679087241051e-09 ] [ 1.413473860578797e-10 6.932299405054064e-10 -2.19440807083043e-09 ] [ 9.752368981978562e-11 1.285383044099079e-10 -5.578799821921671e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 153.75861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.463484501887051e-17 } }