{ "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" [ [ -1.8553868 0.5721361 -0.06539169999999998 ] [ -0.8833377 0.5249776 -1.8654970999999996 ] [ -1.3508412 0.2934061 -0.5387612999999999 ] [ 1.6009377 0.2248064 0.23460569999999994 ] [ -0.5079296 -2.3622605 0.6462759999999999 ] [ 1.0276493 1.138219 2.5831804999999997 ] [ -1.2859495 -2.4777791 -3.377276499999999 ] [ 3.2548578 2.0864943 2.3828644999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.972657353500925e-09 9.16663083335691e-10 -1.047690529343673e-10 ] [ -1.415263011211244e-09 8.411068371636942e-10 -2.988855839790199e-09 ] [ -2.164286189053417e-09 4.70088393820107e-10 -8.631907590518148e-10 ] [ 2.564984954297324e-09 3.601795582862131e-10 3.758797676464185e-10 ] [ -8.137929301322956e-10 -3.784758545339319e-09 1.035448297784141e-09 ] [ 1.646475682841485e-09 1.823627871150355e-09 4.138711404406454e-09 ] [ -2.06031822442945e-09 -3.969839745526865e-09 -5.410993450277249e-09 ] [ 5.214857071188522e-09 3.342932386892462e-09 3.817769792434281e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.858122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.745104473419415e-18 } }