{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4238e-10 0.0 0.0 ] "source-value" [ 5.4238 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] "source-value" [ -0.0012341 5.50722 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] "source-value" [ -0.00966142 -0.113973 5.43239 ] } "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" [ [ -7.556041183121088e-11 -3.825646893790445e-10 1.728314383978963e-10 ] [ -8.865663557316251e-10 5.038417691258247e-10 -9.196070828764108e-10 ] [ 1.644265800628416e-09 1.159384670286125e-10 2.308245763873849e-09 ] [ -1.73834080527193e-10 4.308589390421569e-10 -2.106324085225073e-09 ] [ 3.974535564984767e-11 -3.999474405393493e-09 2.366844252255975e-10 ] [ 9.86430024506089e-10 7.818186117463142e-10 4.87738612345488e-10 ] [ -5.055977547022214e-10 -2.496878508976724e-10 -6.104909763247007e-10 ] [ -1.02888241777444e-09 2.799268998509639e-09 4.309220648010163e-10 ] ] "source-value" [ [ -0.0471611 -0.2387781 0.1078729 ] [ -0.5533512 0.3144733 -0.5739736 ] [ 1.02627 0.0723631 1.4406937 ] [ -0.1084987 0.268921 -1.3146641 ] [ 0.0248071 -2.4962756 0.1477268 ] [ 0.6156812 0.4879728 0.3044225 ] [ -0.3155693 -0.1558429 -0.3810385 ] [ -0.6421779 1.7471663 0.2689604 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.859601782577617e-18 "source-value" -36.572758 } }