{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9790222 -0.6965606 -0.7439577 ] [ 1.5414938 0.8634125 1.0356402 ] [ -0.7069993 1.234599 -1.1477799 ] [ -0.4666416 0.1259395 0.3541282 ] [ -0.8412513 -0.7451854 -2.0692315 ] [ 1.5375555 -0.4180086 -0.6054889 ] [ -0.7001235 0.3928183 2.330074 ] [ 0.6149886 -0.7570147 0.8466155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.568566480084182e-09 -1.11601310829042e-09 -1.19195163380414e-09 ] [ 2.469745327468151e-09 1.38333932160648e-09 1.659278516000636e-09 ] [ -1.132737749381965e-09 1.978045653863059e-09 -1.838946121604162e-09 ] [ -7.476422618127054e-10 2.017773225352416e-10 5.673759228059866e-10 ] [ -1.347833165077607e-09 -1.193918626041496e-09 -3.315274332322915e-09 ] [ 2.463435475282455e-09 -6.697236062133389e-10 -9.701001597339091e-10 ] [ -1.121721503372669e-09 6.293642964824007e-10 3.733190087533939e-09 ] [ 9.853203569785229e-10 -1.212871253941926e-09 1.356427560906902e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.881324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.748821843614994e-18 } }