{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] "source-value" [ 5.37283 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] "source-value" [ -0.256601 5.36059 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] "source-value" [ 0.0433697 -0.246629 5.47376 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.299611352834369e-11 1.962277031561146e-10 -6.863163881689921e-10 ] [ 1.503948774355373e-10 3.407629400364e-10 1.2472944992928e-11 ] [ -3.160293384528e-12 1.634074355143507e-10 -1.714200810126336e-10 ] [ 9.453771325160064e-11 3.50291885488608e-11 1.721852805667277e-10 ] [ 7.106710749817729e-11 1.6119899526024e-10 -1.20091148612064e-11 ] [ 1.29792328051008e-10 -4.123307277285773e-10 6.216108831613632e-11 ] [ -4.489387011195744e-10 8.03787978006048e-11 -2.328667587735552e-11 ] [ -7.668914526056449e-11 -5.646741723703315e-10 6.462131062620575e-10 ] ] "source-value" [ [ 0.0518021 0.1224757 -0.428365 ] [ 0.0938691 0.2126875 0.007785 ] [ -0.0019725 0.1019909 -0.106992 ] [ 0.0590058 0.0218635 0.1074696 ] [ 0.0443566 0.1006125 -0.0074955 ] [ 0.08101 -0.2573566 0.0387979 ] [ -0.2802055 0.0501685 -0.0145344 ] [ -0.0478656 -0.3524419 0.4033345 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.008858013257473e-18 "source-value" 31.262833 } }