{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8476528 0.231819 -0.3777894 ] [ 0.1790483 0.0196625 1.9026421 ] [ -0.3154849 0.2745239 -0.3901241 ] [ -0.0511878 -0.9300454 -1.510733 ] [ -1.4903859 0.4359657 0.4481259 ] [ 3.2020428 -1.1150436 -0.851895 ] [ -0.8675489 2.2571929 1.2708815 ] [ 1.191169 -1.1740749 -0.491108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.960266119515658e-09 3.714149820572352e-10 -6.052853442660595e-10 ] [ 2.868670002539847e-10 3.150279780648e-11 3.048368690369816e-09 ] [ -5.05462530995426e-10 4.398357744308371e-10 -6.250477122306412e-10 ] [ -8.201189643018624e-11 -1.490096996162584e-09 -2.420461092871047e-09 ] [ -2.387861444949967e-09 6.984940520107066e-10 7.179768401549588e-10 ] [ 5.130238112960971e-09 -1.786496787092667e-09 -1.364886252376416e-09 ] [ -1.389966564980757e-09 3.616421693015753e-09 2.036176627107235e-09 ] [ 1.908463123221715e-09 -1.881075355848098e-09 -7.868417558878464e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.937167240654233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.713633337555586e-18 } }