{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7181084 -0.0805418 -3.0711238 ] [ 2.4830811 0.8153647 2.4907412 ] [ 0.7219178 1.3557888 -1.4287406 ] [ -1.2039271 -1.354867 0.3528355 ] [ -0.0189769 2.4677384 -1.2488367 ] [ -0.7215819 -1.5152706 2.6245432 ] [ -0.264579 -0.8861644 -1.6696165 ] [ 0.7221744 -0.8020481 1.9501977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.752713110480094e-09 -1.290421889571495e-10 -4.920482751942455e-09 ] [ 3.978334485970347e-09 1.306358259765606e-09 3.990607319103337e-09 ] [ 1.15663982129937e-09 2.172213118102487e-09 -2.289094786507764e-09 ] [ -1.928903852767544e-09 -2.170736231693433e-09 5.653047890882785e-10 ] [ -3.040434551525952e-11 3.953752770730398e-09 -2.000856963937023e-09 ] [ -1.156101650172443e-09 -2.427731129505589e-09 4.204981755319619e-09 ] [ -4.239022881546432e-10 -1.41979188386526e-09 -2.675020522001923e-09 ] [ 1.157050939820267e-09 -1.285022714577061e-09 3.124561160877932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.119834 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.787035358197694e-18 } }