{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2873873 0.273586 -5.4854618 ] [ 0.9314803 4.4684904 -1.1617876 ] [ 1.9602347 -0.1856791 1.0796465 ] [ 1.1551203 0.1202478 1.0872686 ] [ 1.6230898 -1.699118 4.4921883 ] [ -0.3620082 -3.8695156 -2.3208625 ] [ -4.7351726 1.3261665 0.1476013 ] [ -2.8601317 -0.4341779 2.1614073 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.664798454774835e-09 4.383330929781888e-10 -8.788678650251486e-09 ] [ 1.49239595939577e-09 7.159310849149241e-09 -1.861388931055342e-09 ] [ 3.140642207620902e-09 -2.974907129911853e-10 1.729784381028547e-09 ] [ 1.850706738871482e-09 1.926582138626343e-10 1.741996331449947e-09 ] [ 2.600476531018948e-09 -2.722287135580454e-09 7.197279070491296e-09 ] [ -5.800010745778906e-10 -6.199647428140885e-09 -3.71843163759144e-09 ] [ -7.58658283517275e-09 2.124752961588163e-09 2.36483352059687e-10 ] [ -4.58243614214896e-09 -6.956296806480404e-10 3.462956244086452e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.001087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.607792329398681e-18 } }