{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8057517 2.9516275 -5.639383 ] [ -4.0729298 -3.6682724 2.3737848 ] [ 0.4327834 0.5053774 0.3085015 ] [ 0.1309041 1.162674 1.188292 ] [ 0.1767752 -1.1023319 1.7017783 ] [ -0.2281873 -0.9245756 2.9873285 ] [ 2.3775197 2.2529418 -6.1318519 ] [ -1.6226172 -1.1774407 3.2115497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.495309814545778e-09 4.729028612771835e-09 -9.035287672776821e-09 ] [ -6.525552957482292e-09 -5.877220326427101e-09 3.803222540704363e-09 ] [ 6.933954510630755e-10 8.097038616316715e-10 4.942738948539509e-10 ] [ 2.097314903147994e-10 1.862809115759316e-09 1.903853676769128e-09 ] [ 2.832250949106767e-10 -1.766130413092824e-09 2.726549428508242e-09 ] [ -3.655963602355482e-10 -1.48133342268653e-09 4.786227920782268e-09 ] [ 3.80920651021469e-09 3.609610709721901e-09 -9.824309837328502e-09 ] [ -2.599719363766504e-09 -1.886467977460604e-09 5.14546988826971e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.260701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.649387124066042e-18 } }