{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6914077000000001 -0.18218600000000001 -1.6279090000000005 ] [ -2.4008037000000004 -0.7933690000000002 1.3056869000000002 ] [ 0.4679118000000001 -2.2379344000000003 -0.9221068000000002 ] [ -1.4345348000000002 -1.1822380000000001 2.8047491000000004 ] [ 1.2351451000000002 1.2547775000000003 -2.1347950000000004 ] [ -0.27992530000000004 1.9419574000000004 3.400464700000001 ] [ 1.8077919000000005 0.4141163000000001 -1.3547546000000001 ] [ -0.08699280000000001 0.7848762000000002 -1.4713353000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1077572523811e-09 -2.918941498370688e-10 -2.608197740589908e-09 ] [ -3.846511559270137e-09 -1.271117263467475e-09 2.091941025264828e-09 ] [ 7.496773465564457e-10 -3.585566174564076e-09 -1.477377956840702e-09 ] [ -2.298378118284004e-09 -1.894154083821351e-09 4.493703435229842e-09 ] [ 1.978920602515679e-09 2.010375174805873e-09 -3.420318639200737e-09 ] [ -4.484897712304263e-10 3.111358744869554e-09 5.448145042195688e-09 ] [ 2.896401917451612e-09 6.634874541521992e-10 -2.170556147041256e-09 ] [ -1.393778303379303e-10 1.257510297862345e-09 -2.357339019017755e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.012871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.769897996408631e-18 } }