{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42446e-10 0.0 0.0 ] "source-value" [ 5.42446 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] "source-value" [ -0.00225581 5.46076 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] "source-value" [ -0.0117255 0.0343157 5.56103 ] } "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" [ [ -2.135179446383344e-09 3.718235370955392e-11 6.730133554688275e-10 ] [ 1.632633998361408e-11 1.416680617085328e-09 -3.183945356674898e-09 ] [ -2.54145650996789e-09 8.580315901151771e-10 2.280121636125312e-11 ] [ 6.417124319165683e-09 1.739737903285267e-09 -5.964857096116397e-10 ] [ -1.471400876739145e-09 -5.257884325428416e-09 3.911480301896563e-09 ] [ -7.881462480925017e-10 1.982946712146086e-09 2.830027905711082e-09 ] [ -8.270733721421069e-10 -9.038136268368749e-10 -3.402884233866177e-09 ] [ 1.329805473740365e-09 1.271187759238791e-10 -2.540073190673491e-10 ] ] "source-value" [ [ -1.3326742 0.0232074 0.4200619 ] [ 0.0101901 0.8842225 -1.9872624 ] [ -1.5862524 0.5355412 0.0142314 ] [ 4.005254 1.085859 -0.3722971 ] [ -0.9183762 -3.2817133 2.441354 ] [ -0.4919222 1.237658 1.7663645 ] [ -0.5162186 -0.5641161 -2.1239133 ] [ 0.8299993 0.0793413 -0.1585389 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.795631676638935e-18 "source-value" -36.173488 } }