{ "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" [ 5.36838 0 0 ] "si-unit" "m" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0320632 5.46183 0 ] "si-unit" "m" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0835799 0.195471 5.46165 ] "si-unit" "m" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 22.245407000000004 17.779764100000005 -19.813218600000003 ] [ -2.1801944000000004 4.766727500000001 -4.599917100000001 ] [ 1.3567378000000003 0.15638330000000003 -8.190650000000002 ] [ 0.6838372000000001 2.2050047000000004 11.358260000000001 ] [ 10.421087800000002 -0.8491236000000002 1.1199672000000003 ] [ 1.5587405000000005 -14.134344000000004 -9.069216900000002 ] [ -12.787056100000003 8.587430600000001 6.214135800000002 ] [ -21.298559700000002 -18.511842600000005 22.980639500000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.564107130922004e-08 2.848632259905204e-08 -3.174427588525419e-08 ] [ -3.49305652525765e-09 7.637139421145235e-09 -7.369879695957042e-09 ] [ 2.173733601624565e-09 2.505536692078122e-10 -1.31228680472721e-08 ] [ 1.095627983299985e-09 3.53280700820018e-09 1.819793877489684e-08 ] [ 1.669642337402247e-08 -1.360445991297963e-09 1.794385278686405e-09 ] [ 2.497377607569478e-09 -2.26457156937181e-08 -1.453048740585792e-08 ] [ -2.048712250106717e-08 1.37585806534166e-08 9.9561431792629e-09 ] [ -3.412405468919405e-08 -2.965924166600582e-08 3.681904364127745e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -30.071426 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.817973608826008e-18 } }