{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3758167 0.6800567 0.5425285 ] [ 0.3542489 -0.4830678 0.8384399 ] [ -2.3735065 1.3035198 -1.1470758 ] [ 3.2963279 1.2165739 -3.4941812 ] [ -1.5896288 -0.874843 3.5063243 ] [ 1.4485273 -1.7166751 -0.4057595 ] [ -1.7282577 -1.0553049 -1.3611368 ] [ 4.9681056 0.9297403 1.5208605 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.010831271406987e-09 1.089570954535148e-09 8.692264859790689e-10 ] [ 5.675693102002025e-10 -7.739599417977851e-10 1.343328816793296e-09 ] [ -3.802776654947121e-09 2.088468965516353e-09 -1.837818044186857e-09 ] [ 5.281299539382289e-09 1.949166276114252e-09 -5.59829547360208e-09 ] [ -2.546866120093459e-09 -1.401653013018462e-09 5.617750864686406e-09 ] [ 2.320796593771108e-09 -2.750416733389613e-09 -6.500983899235229e-10 ] [ -2.768974104470581e-09 -1.690784852525707e-09 -2.180781576637531e-09 ] [ 7.95978270756455e-09 1.48960818434815e-09 2.436687156673557e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.292824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.654533796067442e-18 } }