{ "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" [ 5.47613 0 0 ] "si-unit" "m" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968569 5.44973 0 ] "si-unit" "m" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0334568 0.0277585 5.60527 ] "si-unit" "m" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5400262 -0.1524319 -2.6457083 ] [ 0.3811703 0.4412037 1.427285 ] [ -0.3510306 0.5962172 0.25381 ] [ -0.0341566 -0.4918548 0.8412089 ] [ -0.901886 0.291764 1.1165654 ] [ 0.5383181 0.4527149 0.6361958 ] [ -0.1682536 1.550049 -1.6595243 ] [ -0.0041879 -2.687662 0.0301675 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.652173522594651e-10 -2.442228264441235e-10 -4.238891983716512e-09 ] [ 6.107021432033223e-10 7.068862531504569e-10 2.286762658218528e-09 ] [ -5.624130205053965e-10 9.552452587588378e-10 4.066484481252479e-10 ] [ -5.472490596601728e-11 -7.880382613882598e-10 1.347765232788885e-09 ] [ -1.444980663826829e-09 4.674574595910912e-10 1.7889349794742e-09 ] [ 8.624806743734766e-10 7.253292286678099e-10 1.019298037011153e-09 ] [ -2.695719842854349e-10 2.483452268894419e-09 -2.658851035109486e-09 ] [ -6.70975547024832e-12 -4.30610922101257e-09 4.8333663207984e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -25.077801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.017906646327486e-18 } }