{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] "source-value" [ 5.51626 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] "source-value" [ 0.0156708 5.55287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] "source-value" [ 0.0707378 -0.0779479 5.31818 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.602590262466048e-10 6.006191650756415e-11 -3.50139678709632e-12 ] [ -1.741168647007642e-10 -5.164760533044672e-11 1.374664336293158e-10 ] [ -2.340964293300192e-10 2.527390360543239e-10 -1.387009107156423e-10 ] [ 1.804608432484838e-10 3.190347013580966e-10 -4.859054018559686e-10 ] [ -1.285149126312441e-10 -2.584266028405018e-10 4.868979502725543e-10 ] [ 5.415453108901248e-11 -4.553600647980787e-10 -8.765139791774015e-11 ] [ 1.555966642702886e-10 3.59095846019904e-11 -2.331240683388557e-10 ] [ 5.067751943008473e-10 9.768903444705216e-11 3.24518791713433e-10 ] ] "source-value" [ [ -0.224856 0.0374877 -0.0021854 ] [ -0.1086752 -0.0322359 0.0857998 ] [ -0.1461115 0.1577473 -0.0865703 ] [ 0.1126348 0.1991258 -0.3032783 ] [ -0.0802127 -0.1612972 0.3038978 ] [ 0.0338006 -0.2842134 -0.0547077 ] [ 0.0971158 0.022413 -0.1455046 ] [ 0.3163042 0.0609727 0.2025487 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.794032724540098e-18 "source-value" 29.921999 } }