{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7418725 1.6466071 0.2312761 ] [ -4.7997431 -3.6870535 2.1878905 ] [ 0.8552761 -0.3249355 -0.4102895 ] [ 1.6260016 -0.4710315 -0.4390087 ] [ 4.0781077 -0.3696967 0.0038495 ] [ -2.3140015 -0.2735441 -0.874327 ] [ 1.2084137 3.5301116 -4.0293073 ] [ -2.395927 -0.0504575 3.3299164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.790787395914448e-09 2.638155399263287e-09 3.705451603698029e-10 ] [ -7.690036180666115e-09 -5.907310917338813e-09 3.505387007970422e-09 ] [ 1.370303371749003e-09 -5.206040613679585e-10 -6.573562446597215e-10 ] [ 2.605141748903393e-09 -7.546756569603552e-10 -7.03369475467801e-10 ] [ 6.533848814044461e-09 -5.923194095269114e-10 6.167578901769601e-12 ] [ -3.707439103796131e-09 -4.382659617777773e-10 -1.400826278334202e-09 ] [ 1.936092178394425e-09 5.655862274334881e-09 -6.455661954078772e-09 ] [ -3.838698224543481e-09 -8.0841826844016e-11 5.335114205298502e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.296916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.655189360154146e-18 } }