{ "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" [ [ -1.7174171 0.3603797 -0.33957439999999994 ] [ -0.6563111 0.4226482 -1.3839449999999998 ] [ -1.1507 0.1313459 -0.4607149999999999 ] [ 1.2216968 0.3008684 0.4857050999999999 ] [ -0.4991326 -1.8042293 0.4866744999999999 ] [ 0.9023773 0.9469943 2.2695788999999995 ] [ -0.62674 -1.885881 -2.7069864999999997 ] [ 2.5262265 1.5278739 1.6492624999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.751605548452041e-09 5.773919347079297e-10 -5.440581691845695e-10 ] [ -1.051526309054837e-09 6.771570704421587e-10 -2.217324341741129e-09 ] [ -1.8436246527438e-09 2.104393319517006e-10 -7.381468079333097e-10 ] [ 1.957374066792571e-09 4.820443203889655e-10 7.781853622346331e-10 ] [ -7.996985889876683e-10 -2.890694026838176e-09 7.797385122636327e-10 ] [ 1.445767825112008e-09 1.517252139991186e-09 3.636266282599422e-09 ] [ -1.00414818359316e-09 -3.021514472704554e-09 -4.337070518853441e-09 ] [ 4.0474610704916e-09 2.447923862278452e-09 2.642409840832424e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.53113729230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.532498131517466e-18 } }