{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3639933 -2.546388 -0.3865287 ] [ 0.3190377 0.9759508 1.0479721 ] [ 1.3736167 -0.8739812 1.3705048 ] [ -2.0533879 2.3658991 -3.3763181 ] [ -0.383209 -0.5290913 1.0601902 ] [ -1.0135381 2.7341317 -1.7986895 ] [ 3.4272163 -2.9738631 3.3543758 ] [ -2.0337291 0.847342 -1.2715065 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.831815553878407e-10 -4.079763321085671e-09 -6.19287246408217e-10 ] [ 5.111547440938042e-10 1.563645554811057e-09 1.67903639787068e-09 ] [ 2.200776562680447e-09 -1.400272245658729e-09 2.19579074925418e-09 ] [ -3.289890086813609e-09 3.790588225191762e-09 -5.409457924203877e-09 ] [ -6.139685006801472e-10 -8.476977111286791e-10 1.698611952041276e-09 ] [ -1.623867048110053e-09 4.380561887928159e-09 -2.881818264978442e-09 ] [ 5.491005830284679e-09 -4.764653932279812e-09 5.374302484137298e-09 ] [ -3.258393217060625e-09 1.357591542221914e-09 -2.037177987495236e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.156918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.632759207898269e-18 } }