{ "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" [ [ -2.8653194 0.5938396 0.329925 ] [ -0.4947934 -0.4409249 0.6951192 ] [ -1.138598 0.9933143 -0.8715599 ] [ 1.5898262 0.5127438 -2.350818 ] [ -0.2793348 -0.4283436 2.5142892 ] [ 0.6481188 -1.3971591 -0.3083769 ] [ -0.8858891 -0.7806418 -1.3376545 ] [ 3.4259898 0.9471717 1.329076 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.5907477916269e-09 9.514359314639064e-10 5.2859812597245e-10 ] [ -7.927464241374155e-10 -7.064395721287866e-10 1.113703740084773e-09 ] [ -1.824235111119132e-09 1.591464961678066e-09 -1.396392906911376e-09 ] [ 2.547182389761011e-09 8.215061355883691e-10 -3.766425670386611e-09 ] [ -4.475436896230631e-10 -6.862821072434423e-10 4.028335407358552e-09 ] [ 1.038400797416119e-09 -2.238495664000469e-09 -4.940742636453545e-10 ] [ -1.419350816335289e-09 -1.250726051483701e-09 -2.143158784264953e-09 ] [ 5.489040805882333e-09 1.517536366126058e-09 2.129414512010184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.790853 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.734326838752879e-18 } }