{ "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" [ [ 1.164777276356413e-09 2.97766143174067e-09 9.21133636760709e-10 ] [ -2.320880849140802e-09 -6.719155440482554e-10 -3.917340743540125e-09 ] [ 2.922447381252323e-09 2.983377196835375e-09 -2.636958252892226e-09 ] [ -1.290982971824099e-09 -2.956282147130377e-09 3.92793321383322e-09 ] [ -5.128029031836211e-10 3.355859709175048e-09 2.346251956801818e-09 ] [ 4.532384625168154e-10 -4.862268145078673e-09 2.509577360873184e-09 ] [ -3.048702263542267e-09 8.703210858850234e-10 -1.871068481109905e-09 ] [ 2.632905867565237e-09 -1.69675358737881e-09 -1.279528690726675e-09 ] ] "source-value" [ [ 0.7269968 1.8585101 0.5749264 ] [ -1.4485799 -0.4193767 -2.4450118 ] [ 1.8240482 1.8620776 -1.6458599 ] [ -0.8057682 -1.8451662 2.4516231 ] [ -0.3200664 2.0945629 1.4644153 ] [ 0.2828892 -3.0347891 1.566355 ] [ -1.9028503 0.5432117 -1.1678291 ] [ 1.6433306 -1.0590303 -0.798619 ] ] } "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" -5.387962962441562e-18 "source-value" -33.62902 } }