{ "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" [ [ 0.7664085 0.8683261 -3.0500929 ] [ 0.04441 -0.1483897 2.8021008 ] [ 0.757626 -1.059784 1.1338348 ] [ -1.5714342 -1.6272575 2.0565767 ] [ 1.5307053 1.9805949 -2.1063883 ] [ 0.3607446 -0.5507353 -1.1917005 ] [ 0.6647708 1.3025819 -0.7907446 ] [ -2.553231 -0.7653363 1.1464139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.227921780682397e-09 1.391211776650443e-09 -4.886787535648073e-09 ] [ 7.1152663729728e-11 -2.377465081075258e-10 4.489460390884977e-09 ] [ 1.213850664510221e-09 -1.697961147897907e-09 1.816603608409444e-09 ] [ -2.517715136365551e-09 -2.607153922521456e-09 3.294999107622015e-09 ] [ 2.45246024499465e-09 3.173262844055714e-09 -3.374806088586657e-09 ] [ 5.779765641998477e-10 -8.823752219092744e-10 -1.909314680095671e-09 ] [ 1.065080233950513e-09 2.086966266857244e-09 -1.266912511143848e-09 ] [ -4.090727015701804e-09 -1.226203926909575e-09 1.836757548340149e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.694128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.636000131104266e-18 } }