{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7499519000000001 0.4812681000000001 -1.2747773000000002 ] [ 1.1346474000000002 -0.7088158000000001 -0.9374347000000002 ] [ -0.35426480000000005 0.16351030000000003 1.6009649000000004 ] [ -0.27417830000000004 0.7757711000000003 -0.11700250000000002 ] [ -3.094893900000001 -4.201767500000001 -3.599814500000001 ] [ 3.3493907000000007 3.9690372000000007 3.514681000000001 ] [ 0.5129932000000001 -0.33304170000000005 0.25796470000000005 ] [ -2.0236461000000006 -0.14596170000000003 0.5554184000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.20155540090454e-09 7.710764981568367e-10 -2.042418386786548e-09 ] [ 1.817905537131506e-09 -1.135648103213649e-09 -1.501935959866662e-09 ] [ -5.67594780132388e-10 2.619723799199943e-10 2.565028533501411e-09 ] [ -4.392820621906887e-10 1.242922319512299e-09 -1.874586700751521e-10 ] [ -4.958566650436535e-09 -6.731973654537265e-09 -5.767538631116843e-09 ] [ 5.366315473464948e-09 6.359098608925495e-09 5.631139727769966e-09 ] [ 8.219057116693788e-10 -5.335916254914875e-10 4.133050113316858e-10 ] [ -3.2422384701931e-09 -2.338564232722234e-10 8.898783752421429e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.798988 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.735630162189976e-18 } }