{ "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" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] } "unrelaxed-configuration-positions" { "source-unit" "angstrom" "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-configuration-forces" { "source-unit" "eV/angstrom" "source-value" [ [ -1.04169 -0.877435 -0.39367 ] [ -0.09734 -0.07095 1.868011 ] [ 0.825302 -0.512686 -0.266832 ] [ -0.832676 0.282983 -0.66552 ] [ -0.319692 -0.319513 -1.446911 ] [ 0.502913 0.471207 0.556886 ] [ -0.100744 -1.117039 -1.075684 ] [ 1.063928 2.143433 1.423719 ] ] } "unrelaxed-potential-energy" { "source-unit" "eV" "source-value" -35.780982 } }