{ "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" [ [ 3.63216980745692e-09 -1.93597089362423e-10 -5.973359687225321e-09 ] [ 1.824968412328979e-09 4.480024051241451e-09 -1.364802458539148e-09 ] [ 2.546093529543809e-09 9.1288018411632e-11 2.087702627232163e-09 ] [ 1.981120551233699e-09 -4.515742816607904e-10 1.432337247241448e-09 ] [ 5.480072096371354e-10 -1.485273483228004e-09 5.846317495343915e-09 ] [ -2.133857971106508e-09 -4.319713462917445e-09 -2.590281080092487e-09 ] [ -5.018174990742749e-09 1.612884127374468e-09 -1.294615426658776e-09 ] [ -3.380326388133623e-09 2.659622803587725e-10 1.856701442915868e-09 ] ] "source-value" [ [ 2.2670221 -0.1208338 -3.7282779 ] [ 1.1390557 2.7962111 -0.8518427 ] [ 1.5891466 0.0569775 1.3030415 ] [ 1.2365182 -0.2818505 0.8939946 ] [ 0.3420392 -0.9270348 3.6489844 ] [ -1.3318494 -2.6961531 -1.6167263 ] [ -3.1320985 1.0066831 -0.8080354 ] [ -2.1098338 0.1660006 1.1588619 ] ] } "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" -5.291975279348138e-18 "source-value" -33.029912 } }