{ "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" [ [ 2.220209523131793e-09 2.658683928087936e-11 -5.14893967978492e-09 ] [ 1.595807808514658e-09 4.115285018727766e-09 -1.210634775596951e-09 ] [ 1.78425710439445e-09 -2.081820235768896e-10 1.329851456209382e-09 ] [ 1.780834534697098e-09 -9.281361098995777e-11 1.461946432499804e-09 ] [ 1.159930692078494e-09 -1.1055065146642e-09 4.856972470693943e-09 ] [ -1.015809137201699e-09 -3.828515270594663e-09 -2.500290504308379e-09 ] [ -5.126314061981307e-09 1.130179393753872e-09 -5.149581511739214e-10 ] [ -2.398916463633487e-09 -3.703367171914368e-11 1.726052751461042e-09 ] ] "source-value" [ [ 1.3857458 0.0165942 -3.2137154 ] [ 0.9960249 2.5685589 -0.7556188 ] [ 1.1136457 -0.129937 0.830028 ] [ 1.1115095 -0.0579297 0.9124752 ] [ 0.7239718 -0.6900029 3.0314838 ] [ -0.6340182 -2.3895713 -1.5605586 ] [ -3.1995936 0.7054025 -0.3214116 ] [ -1.4972859 -0.0231146 1.0773174 ] ] } "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" -5.33800805671099e-18 "source-value" -33.317226 } }