{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.629168 2.9932523 -2.2950491 ] [ -0.9033847 1.3206055 -2.3961998 ] [ -2.1615654 -2.243682 -2.0588046 ] [ 0.2538624 -0.3354474 3.2934111 ] [ 2.5439977 0.4304262 0.500456 ] [ 1.4725355 -0.487693 -0.265054 ] [ -1.0362565 0.4375431 0.8852181 ] [ -1.798357 -2.1150047 2.3360223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.610214880955494e-09 4.795718855215828e-09 -3.677074011608081e-09 ] [ -1.447381845928422e-09 2.115843257399895e-09 -3.839135298325637e-09 ] [ -3.463209548210201e-09 -3.594774844909786e-09 -3.298568596915496e-09 ] [ 4.067324021801779e-10 -5.374459817881459e-10 5.276626267103211e-09 ] [ 4.075933638308972e-09 6.896187946197849e-10 8.018189029390849e-10 ] [ 2.359261951398038e-09 -7.813703227278143e-10 -4.246633220495233e-10 ] [ -1.660265937452035e-09 7.010213254123565e-10 1.418275744128997e-09 ] [ -2.881285541252025e-09 -3.388611083222118e-09 3.742720314727444e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.754328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.408039517241483e-18 } }