{ "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 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0118271 -0.9041004 -0.347859 ] [ -0.0501088 0.0002743 1.7360157 ] [ 0.8606323 -0.4626715 -0.346535 ] [ -0.7524429 0.233736 -0.5496485 ] [ -0.2725357 -0.3410842 -1.475042 ] [ 0.3987562 0.5137079 0.6066625 ] [ -0.1055919 -1.0332716 -0.9904886 ] [ 0.9331179 1.9934096 1.3668949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.621125723911864e-09 -1.448528523735928e-09 -5.573315571348672e-10 ] [ -8.028314785634305e-11 4.3947704708544e-13 2.781403767881747e-09 ] [ 1.378884950165332e-09 -7.412814604104672e-10 -5.55210275288928e-10 ] [ -1.205546422866952e-09 3.744863546393088e-10 -8.806339763577888e-10 ] [ -4.366503268733626e-10 -5.464771309642713e-10 -2.363277807098074e-09 ] [ 6.38877861039049e-10 8.230507873002643e-10 9.7198047421608e-10 ] [ -1.691768735258515e-10 -1.655483600456609e-09 -1.586937678088923e-09 ] [ 1.495019683829992e-09 3.19379425679828e-09 2.190007051870754e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.569071038775913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.814875486750114e-18 } }