{ "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" [ [ 0.5009444 -2.5023215 -0.2500626 ] [ 0.132409 1.1530392 0.7013952 ] [ 1.2164218 -0.854321 1.4925795 ] [ -1.7254959 2.2336314 -2.9597099 ] [ -0.4666508 -0.8469591 1.1393781 ] [ -0.6380958 2.5673978 -1.4476024 ] [ 2.7551158 -2.5581114 2.7362895 ] [ -1.7746485 0.8076445 -1.4122674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.026014060006835e-10 -4.009161005025187e-09 -4.006444514564621e-10 ] [ 2.121426041835072e-10 1.847372449105936e-09 1.12375899138134e-09 ] [ 1.948922568991453e-09 -1.368773132858477e-09 2.391375979585353e-09 ] [ -2.764549190266255e-09 3.578672008564773e-09 -4.741978006130306e-09 ] [ -7.476570018376166e-10 -1.356978068793809e-09 1.825484954071525e-09 ] [ -1.022342172590673e-09 4.113424731453354e-09 -2.31931472149397e-09 ] [ 4.414182122356689e-09 -4.098546278481958e-09 4.384019064640522e-09 ] [ -2.843300336837789e-09 1.293989135817706e-09 -2.262701810598002e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.454942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.238548957702e-18 } }