{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4061114 0.3888701 -0.03333819999999999 ] [ -0.8063854 0.4416849 -1.5373821999999995 ] [ -1.0639156 0.2488155 -0.30970999999999993 ] [ 1.1139815 0.1658521 0.2506962999999999 ] [ -0.2936484 -1.8829528 0.6015836999999999 ] [ 0.9155648 0.8607495 1.9080699999999995 ] [ -1.1198588 -1.8948934 -2.6264371999999994 ] [ 2.6603733 1.6718741 1.7465175999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.252838811320357e-09 6.230385827481581e-10 -5.341368461955455e-11 ] [ -1.291971835234456e-09 7.07657220540386e-10 -2.463157818074069e-09 ] [ -1.704580700824405e-09 3.986463769926624e-10 -4.962101212279679e-10 ] [ 1.784795115303715e-09 2.657243571305837e-10 4.016597507810629e-10 ] [ -4.704766012153267e-10 -3.016822954229899e-09 9.63843339594361e-10 ] [ 1.466896517387428e-09 1.37907272526529e-09 3.057065144849855e-09 ] [ -1.794211587957143e-09 -3.035953904388223e-09 -4.208016277839413e-09 ] [ 4.262387903860545e-09 2.678637595941042e-09 2.798229666535725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.788906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.734014847720884e-18 } }