{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7527261 -13.3044374 23.4965656 ] [ 1.5657427 4.2867748 -7.3182775 ] [ -0.7569381 -0.3186502 3.2674263 ] [ -1.1009776 -0.654578 -6.9736402 ] [ -0.8616279 -1.29005 2.1552769 ] [ 0.2864523 1.7766717 -4.3262691 ] [ -1.0178109 -6.6431572 6.2616893 ] [ 15.6378855 16.1474263 -16.5627714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.203429641122194e-08 -2.131605873079571e-08 3.764564838356818e-08 ] [ 2.508596368796071e-09 6.868170419780022e-09 -1.172517321162793e-08 ] [ -1.212748537204355e-09 -5.105339048594267e-10 5.234994071177074e-09 ] [ -1.763960585277398e-09 -1.048749576730452e-09 -1.117300338236309e-08 ] [ -1.380480088582489e-09 -2.0668879666917e-09 3.453134288979954e-09 ] [ 4.589471818155582e-10 2.846541884029057e-09 -6.931447264416209e-09 ] [ -1.63071284181051e-09 -1.064351124182886e-08 1.003233228582781e-08 ] [ 2.505465475326741e-08 2.587102911709707e-08 -2.653648533136346e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -27.9846 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.48362722318364e-18 } }