{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4935761 -1.7149028 -0.8377049 ] [ 2.6315431 -1.8334731 0.1385418 ] [ -1.3829806 4.0409384 0.4713583 ] [ 0.5058714 -0.14091130000000004 -2.8043308 ] [ -2.8756484 3.2965653 4.4491079 ] [ -2.9940501 -1.9241484 1.8286347 ] [ 2.9464738 1.1499582 -2.0760367 ] [ 3.6623669 -2.8740262 -1.1695704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.995149362520847e-09 -2.747577195741175e-09 -1.342151216967306e-09 ] [ 4.216196866183925e-09 -2.937547759887545e-09 2.219684347923012e-10 ] [ -2.2157792025953e-09 6.474297083913345e-09 7.551992545019621e-10 ] [ 8.104953368888675e-10 -2.257647923265642e-10 -4.493033281766527e-09 ] [ -4.607296674079485e-09 5.2816798961152e-09 7.128256719524808e-09 ] [ -4.796997111245362e-09 -3.082825606828485e-09 2.9297957884616e-09 ] [ 4.720771475053189e-09 1.842436158116699e-09 -3.326177492066467e-09 ] [ 5.867758672315014e-09 -4.604697623143811e-09 -1.873858366698034e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.686787292303478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.435912367025676e-18 } }