{ "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" [ [ -3.976825556028877e-09 5.313235842670828e-10 1.428026430825523e-10 ] [ -1.520355062952365e-10 -9.2960290259592e-10 1.184838770696099e-09 ] [ -2.039211630280016e-09 1.604029217626631e-09 -1.033610280764759e-09 ] [ 2.599471004971734e-09 1.209211722322357e-09 -3.432216082351473e-09 ] [ -8.900333057213741e-10 -8.661285101037138e-10 3.556805662261757e-09 ] [ 1.272767024733913e-09 -1.866326358747662e-09 -6.8956912714454e-10 ] [ -1.302402966341837e-09 -7.484089033257581e-10 -1.398237160914989e-09 ] [ 4.488270934961694e-09 1.065902310774645e-09 1.669185575135353e-09 ] ] "source-value" [ [ -2.4821393 0.3316261 0.0891304 ] [ -0.0948931 -0.5802125 0.7395182 ] [ -1.2727758 1.0011563 -0.6451288 ] [ 1.6224622 0.7547306 -2.1422208 ] [ -0.5555151 -0.5405949 2.2199835 ] [ 0.7943987 -1.1648693 -0.4303952 ] [ -0.812896 -0.4671201 -0.872711 ] [ 2.8013584 0.6652839 1.0418237 ] ] } "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" -5.750634866679092e-18 "source-value" -35.89264 } }