{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] "source-value" [ 5.47613 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] "source-value" [ -0.0968569 5.44973 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] "source-value" [ -0.0334568 0.0277585 5.60527 ] } "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" [ [ 1.051330193973145e-09 -2.073179697252922e-10 -5.252406483561902e-09 ] [ 8.158789640925773e-10 1.016328082209176e-09 2.984623369811033e-09 ] [ -6.111521946161049e-10 1.011808982832547e-09 6.098236697621377e-10 ] [ -1.674756823898861e-10 -7.803154496406796e-10 1.22564124248035e-09 ] [ -1.819090346742588e-09 6.143669620057401e-10 2.473992857907554e-09 ] [ 1.042613552067683e-09 9.721078472574337e-10 1.091172801743875e-09 ] [ -1.792870886560858e-10 2.790649768942721e-09 -3.08447966857304e-09 ] [ -1.328175579464026e-10 -5.417628223881646e-09 -4.836778957000704e-11 ] ] "source-value" [ [ 0.6561887 -0.1293977 -3.2782943 ] [ 0.5092316 0.6343421 1.8628554 ] [ -0.3814512 0.6315215 0.380622 ] [ -0.1045301 -0.4870346 0.7649851 ] [ -1.1353869 0.3834577 1.5441449 ] [ 0.6507482 0.606742 0.6810565 ] [ -0.1119022 1.7417866 -1.9251808 ] [ -0.0828982 -3.3814176 -0.0301888 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.740606843209505e-18 "source-value" -35.83005 } }