{ "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" [ 5.40034 0 0 ] "si-unit" "m" "si-value" [ 5.40034e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00680429 5.47714 0 ] "si-unit" "m" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0750519 0.000428382 5.30288 ] "si-unit" "m" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3634929 1.1103748 0.317951 ] [ -0.9293598 -0.1426372 -1.3188872 ] [ 1.1354157 1.2171867 -1.0537655 ] [ -0.3946216 -1.1970607 1.319923 ] [ 0.0736393 1.3081503 0.8974887 ] [ -0.1652891 -1.9680992 0.8722438 ] [ -1.2259565 0.3100937 -0.6823001 ] [ 1.1426789 -0.6380085 -0.3526538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.823798262067924e-10 1.779016544885476e-09 5.094136587599808e-10 ] [ -1.488998543871364e-09 -2.285299870963737e-10 -2.113090237312374e-09 ] [ 1.819136489429267e-09 1.950148073888703e-09 -1.688318447905622e-09 ] [ -6.322535015826893e-10 -1.917902667218483e-09 2.114749771856198e-09 ] [ 1.179831648320775e-10 2.095887827152506e-09 1.437935412572185e-09 ] [ -2.648223316930733e-10 -3.153242525655183e-09 1.397488623997751e-09 ] [ -1.964198842417795e-09 4.96824876397369e-10 -1.093165268589502e-09 ] [ 1.830773418661461e-09 -1.022202302571677e-09 -5.650136735962791e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.199348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.197598284580324e-18 } }