{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] "source-value" [ 5.36644 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] "source-value" [ -0.227231 5.37948 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] "source-value" [ -0.0350261 -0.0899265 5.39939 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.753339261272225e-09 5.084998733460737e-09 4.956381441743423e-11 ] [ -2.841706171100093e-09 1.971308661390257e-09 -1.016065485461027e-09 ] [ 3.954630122647949e-09 4.449105246813252e-09 -3.488522977512868e-09 ] [ -1.984740669308396e-09 1.126896373640191e-09 -7.271617822649148e-09 ] [ 1.510959578812669e-09 -2.198120954931471e-09 4.727558576760768e-09 ] [ -4.167876626523187e-09 -3.740724002657927e-09 4.660128890844793e-09 ] [ 7.208440954355424e-09 -3.25593563834198e-09 3.123872064713326e-09 ] [ -5.433046610374253e-09 -3.437528419373059e-09 -7.849172213309414e-10 ] ] "source-value" [ [ 1.0943483 3.1738066 0.0309353 ] [ -1.7736535 1.2303941 -0.6341782 ] [ 2.468286 2.7769131 -2.1773648 ] [ -1.2387777 0.7033534 -4.5385869 ] [ 0.9430668 -1.3719592 2.95071 ] [ -2.601384 -2.3347763 2.9086237 ] [ 4.499155 -2.0321952 1.9497676 ] [ -3.391041 -2.1455365 -0.4899068 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.614818354533875e-18 "source-value" -35.04494 } }