{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40034e-10 0.0 0.0 ] "source-value" [ 5.40034 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] "source-value" [ -0.00680429 5.47714 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] "source-value" [ 0.0750519 0.000428382 5.30288 ] } "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" [ [ -1.388379609037855e-09 -1.260039013222953e-08 -5.192705377229342e-09 ] [ 3.977540767672402e-09 9.969201157131149e-09 4.180227005004624e-09 ] [ 1.205259312816505e-08 4.067672655434465e-09 -6.655456743263435e-09 ] [ -1.302543845732104e-08 4.149882260459658e-09 3.057699286356369e-09 ] [ -5.687683745071238e-09 5.899371491312101e-09 2.119537876687459e-09 ] [ -6.303172390929201e-09 -1.753899382218856e-09 8.376652015645537e-09 ] [ 2.49974752665159e-09 -8.518504567991954e-09 2.953569181458376e-09 ] [ 7.874792459434965e-09 -1.213333481897026e-09 -8.839523244659587e-09 ] ] "source-value" [ [ -0.8665584 -7.864545 -3.2410318 ] [ 2.4825857 6.222286 2.6090925 ] [ 7.522637 2.5388416 -4.1540094 ] [ -8.1298393 2.5901528 1.9084658 ] [ -3.549973 3.6820981 1.3229115 ] [ -3.9341308 -1.0946979 5.228295 ] [ 1.5602197 -5.3168324 1.8434729 ] [ 4.9150589 -0.7573032 -5.5171965 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.899208129802943e-18 "source-value" -18.095434 } }