{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9768137 -1.011004 -2.6277305 ] [ 3.8799293 -1.7832997 -0.9663443 ] [ -2.3705793 4.5162264 3.0524905 ] [ 0.794432 -0.09641500000000006 -2.7313881 ] [ -3.1479214 4.5517171 6.6067282 ] [ -3.5551183 -2.1704429 2.8769816 ] [ 3.4988387 -0.22037730000000008 -4.357536 ] [ 3.8772329 -3.7864046 -1.8532015 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.769381314617145e-09 -1.619806972335283e-09 -4.210088372863095e-09 ] [ 6.216332014816909e-09 -2.857161087219653e-09 -1.548254245103341e-09 ] [ -3.79808673221243e-09 7.235792352319749e-09 4.890628914314102e-09 ] [ 1.272820377215386e-09 -1.544738588944321e-10 -4.376166156151333e-09 ] [ -5.043526071196005e-09 7.292654722115576e-09 1.058514546202007e-08 ] [ -5.695927424438241e-09 -3.477432871161352e-09 4.609432657991778e-09 ] [ 5.605757565090265e-09 -3.53083357815028e-10 -6.981542303494348e-09 ] [ 6.212011905776585e-09 -6.066488927009576e-09 -2.969156116931491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.767323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.410121545760212e-18 } }