{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2093663 1.0881324 -2.2500181 ] [ -0.5778404 0.2774749 0.4907666 ] [ -0.4309897 -0.6053202 -1.446847 ] [ -1.4234489 -1.0517087 3.3799616 ] [ 3.4182378 1.7784035 -1.9766827 ] [ -0.2474053 -1.6974368 -0.1670837 ] [ -0.1901262 0.8563046 -0.0603704 ] [ -1.7577936 -0.6458497 2.0302735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.937618411843399e-09 1.743380291614994e-09 -3.604926396196837e-09 ] [ -9.258023794337204e-10 4.44563797638818e-10 7.862947727895052e-10 ] [ -6.905216211456057e-10 -9.698298725379802e-10 -2.318104437274618e-09 ] [ -2.280616548483477e-09 -1.685023091031961e-09 5.415295454721762e-09 ] [ 5.476620687494826e-09 2.849316510048893e-09 -3.16699480867982e-09 ] [ -3.963869875220102e-10 -2.719593556245566e-09 -2.67697597856761e-10 ] [ -3.04615752641545e-10 1.371951210403496e-09 -9.672404346834432e-11 ] [ -2.816295810111867e-09 -1.034765289890694e-09 3.252856735529789e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.056782038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.732797740860814e-18 } }