{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8658471 0.5975093 1.2783055 ] [ -65.784159 -78.8902537 56.4100163 ] [ -5.9146998 -7.1826533 -11.4703724 ] [ 6.8229152 8.4757318 10.2337162 ] [ 6.2783212 -7.2204492 5.7696721 ] [ -2.0693528 -2.359367 1.398342 ] [ 52.3709304 75.1124789 -75.1270667 ] [ 7.4301978 11.4670032 11.507387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.38723998080748e-09 9.573154311705735e-10 2.048071186340055e-09 ] [ -1.053978415687899e-07 -1.263961200871207e-07 9.037880929480693e-08 ] [ -9.476393738610437e-09 -1.150787919257197e-08 -1.837756249114959e-08 ] [ 1.093151521914096e-08 1.35796193341311e-08 1.639622083954222e-08 ] [ 1.0058979444513e-08 -1.156843489991406e-08 9.24403374830204e-09 ] [ -3.315468676347018e-09 -3.780122647287034e-09 2.240390860282714e-09 ] [ 8.3907480296424e-08 1.203434576239133e-07 -1.203668298560222e-07 ] [ 1.19044892030796e-08 1.837216443767879e-08 1.843686641789785e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -45.805017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.338772735274656e-18 } }