{ "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" [ 5.44976 0 0 ] "si-unit" "m" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0355309 5.38277 0 ] "si-unit" "m" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.05055 0.148675 5.46244 ] "si-unit" "m" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0428915 0.9886215 -3.2382925 ] [ 0.1092602 -0.1009269 2.6859766 ] [ 0.8843113 -1.3194131 1.4181819 ] [ -1.9894242 -1.8907202 2.3175634 ] [ 1.963167 2.2816226 -2.3520387 ] [ 0.4743011 -0.5440302 -1.3021549 ] [ 0.7021211 1.5049243 -0.691236 ] [ -3.186628 -0.920078 1.1620002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.670896379331043e-09 1.583946254120227e-09 -5.188316534811984e-09 ] [ 1.750541380239322e-10 -1.617027195898195e-10 4.303408912535874e-09 ] [ 1.416822890369255e-09 -2.113932821997253e-09 2.272177884221724e-09 ] [ -3.187408942093744e-09 -3.0292677009143e-09 3.713145896701759e-09 ] [ 3.145340270126074e-09 3.65556238720891e-09 -3.768381416356825e-09 ] [ 7.599141336397228e-10 -8.716324674491482e-10 -2.086282137440162e-09 ] [ 1.124922011390379e-09 2.411154529533806e-09 -1.107482158655309e-09 ] [ -5.105540880786663e-09 -1.474127460912422e-09 1.861729553804924e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.661044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.713529097012011e-18 } }