{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1287069 0.170915 0.07320269999999998 ] [ -0.1701632 -0.0203849 -0.22094369999999994 ] [ -0.1921559 0.1280921 0.07262829999999999 ] [ 0.0961198 -0.0279367 -0.08047569999999998 ] [ 0.1055064 -0.2101919 0.16877819999999996 ] [ 0.0761296 0.0434526 0.29223409999999994 ] [ -0.1389552 -0.2066608 -0.3112598999999999 ] [ 0.3522254 0.1227146 0.005835899999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.062111861156436e-10 2.738360171440321e-10 1.172836545194361e-10 ] [ -2.726315007605146e-10 -3.266021019734593e-11 -3.539908306530489e-10 ] [ -3.078676905287827e-10 2.052261679291757e-10 1.163633642684486e-10 ] [ 1.540008963559719e-10 -4.475952760230336e-11 -1.289362850825145e-10 ] [ 1.690398874247731e-10 -3.367645480615315e-10 2.704124861407065e-10 ] [ 1.219730652708557e-10 6.961873983297409e-11 4.682106428205292e-10 ] [ -2.226307727785882e-10 -3.311071021958247e-10 -4.986933347725458e-10 ] [ 5.643273011319283e-10 1.966104631508237e-10 9.350142541326719e-12 ] ] } "unrelaxed-potential-energy" { "source-value" 28.915922 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.632841419727638e-18 } }