{ "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" [ [ -1.2699134 0.3862273 -0.11496419999999997 ] [ -0.7021625 0.4689169 -1.3144478999999998 ] [ -1.0177796 0.1243447 -0.25573169999999995 ] [ 0.970555 0.2155875 0.36873619999999996 ] [ -0.1689244 -1.7353405 0.4487356999999999 ] [ 0.8133547 0.8233841 1.7793696999999995 ] [ -1.0980803 -1.919117 -2.5377051999999996 ] [ 2.4729505 1.635997 1.6260074999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.034625576683496e-09 6.188043554729082e-10 -1.841929549865028e-10 ] [ -1.124988350771025e-09 7.512877004677145e-10 -2.105977711990368e-09 ] [ -1.630662693681866e-09 1.992221729017398e-10 -4.097273543130977e-10 ] [ 1.55500054301187e-09 3.45409255082475e-10 5.907805237499508e-10 ] [ -2.706467265924696e-10 -2.780322001133876e-09 7.189538533816335e-10 ] [ 1.30313789549408e-09 1.319206765827119e-09 2.850864556587589e-09 ] [ -1.75931859891571e-09 -3.074764415312178e-09 -4.065851975420296e-09 ] [ 3.962103508138617e-09 2.621156166694098e-09 2.605151223208754e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.831903074190162 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.138727151722024e-18 } }