{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3321915 1.9826833 -2.5605537 ] [ 0.235752 0.3909788 0.3796624 ] [ 0.3946889 1.3192437 -1.110055 ] [ -0.725875 -1.175805 0.8219356 ] [ 0.8923368 0.6316132 0.5794034 ] [ -0.2377972 -1.83224 -0.2188714 ] [ -0.7017779 0.6982958 0.3956551 ] [ -1.1895191 -2.0147698 1.7128236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.134406075728483e-09 3.176608829710592e-09 -4.102459274442937e-09 ] [ 3.777163427068416e-10 6.264170925884391e-10 6.08286221076818e-10 ] [ 6.323613280692692e-10 2.113661413277689e-09 -1.778504168802144e-09 ] [ -1.1629799546232e-09 -1.883847281619744e-09 1.31688600212322e-09 ] [ 1.429681158839485e-09 1.011955902428675e-09 9.283065814920307e-10 ] [ -3.809931143317017e-10 -2.935572091694592e-09 -3.506706400417651e-10 ] [ -1.12437214437412e-09 1.118793205162833e-09 6.339093511202861e-10 ] [ -1.905819692015057e-09 -3.228017069853892e-09 2.744245927474491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.127489 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.705432217360917e-18 } }