{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43103e-10 0.0 0.0 ] "source-value" [ 5.43103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] "source-value" [ 0.00138287 5.43667 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] "source-value" [ -0.0279747 -0.147199 5.47761 ] } "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" [ [ 9.814277086606273e-11 -2.537911854412032e-11 -6.772812335513146e-10 ] [ 3.0205419266021e-10 3.817206627352071e-10 -9.893008045752384e-11 ] [ 2.308283094589113e-10 -2.862576924850944e-11 2.318711662213901e-10 ] [ 3.666693349064256e-10 1.082408094539789e-10 1.803315475951853e-10 ] [ 1.372402062904589e-10 -7.185714078989377e-11 6.255205145514394e-10 ] [ -3.634745947245504e-11 -3.369491188082477e-10 -2.994456889038854e-10 ] [ -8.760265970493541e-10 6.641598876799488e-11 -1.562251981586285e-10 ] [ -2.225605974425971e-10 -9.35663135664096e-11 1.941588124856755e-10 ] ] "source-value" [ [ 0.0612559 -0.0158404 -0.4227257 ] [ 0.1885274 0.2382513 -0.0617473 ] [ 0.1440717 -0.0178668 0.1447226 ] [ 0.228857 0.0675586 0.1125541 ] [ 0.0856586 -0.0448497 0.3904192 ] [ -0.0226863 -0.2103071 -0.1868993 ] [ -0.5467728 0.0414536 -0.0975081 ] [ -0.1389114 -0.0583995 0.1211844 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.848028800361313e-18 "source-value" 30.259016 } }