{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8448785 8.6043942 20.1592166 ] [ -12.2656171 -8.9654531 8.0076965 ] [ 2.8109384 0.21297060000000012 -11.2999979 ] [ 12.9819305 -12.4309354 -3.8289312 ] [ -8.5870717 -1.7165423 -7.5619178 ] [ 3.7092378 8.5016333 10.4750735 ] [ -0.4512743 6.3592743 -12.4162667 ] [ 10.6467349 -0.5653415 -3.534873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.417105766326897e-08 1.378575933696512e-08 3.229862579626492e-08 ] [ -1.965168511921084e-08 -1.436423947004286e-08 1.282974422446358e-08 ] [ 4.503619824093345e-09 3.412165190489606e-10 -1.810459259962906e-08 ] [ 2.079934571131194e-08 -1.991655423664344e-08 -6.134624101833581e-09 ] [ -1.375800563222266e-08 -2.750203964332618e-09 -1.211552800738868e-08 ] [ 5.942854133109565e-09 1.362111822409631e-08 1.67829180011326e-08 ] [ -7.230211389847062e-10 1.01886806926567e-08 -1.989305238825229e-08 ] [ 1.705794988517233e-08 -9.057769415305111e-10 -5.663490924757482e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.7839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.97081854793926e-18 } }