{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7379942000000004 1.8866716000000003 -0.22131170000000006 ] [ -0.7302697000000001 -0.4395312000000001 0.4218013000000001 ] [ 0.031227900000000006 0.30203650000000004 -0.9265528000000002 ] [ 0.35570070000000004 -0.5646298000000001 -0.5488608000000001 ] [ 0.016724800000000005 0.35437480000000005 -0.4277292000000001 ] [ 0.16774360000000002 -0.009755200000000002 -0.8949344000000002 ] [ -0.30730830000000003 0.6347535000000001 0.4568949000000001 ] [ -1.2718133000000003 -2.1639202000000006 2.1406927000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.784573697267523e-09 3.022781153551395e-09 -3.545804345708179e-10 ] [ -1.17002104985819e-09 -7.042066185539809e-10 6.758001870508242e-10 ] [ 5.00326117088886e-11 4.83915822915141e-10 -1.484501246327275e-09 ] [ 5.698953502374438e-10 -9.046366724200932e-10 -8.793719490785473e-10 ] [ 2.67960837683232e-11 5.677710242384232e-10 -6.852977299195129e-10 ] [ 2.687548764230424e-10 -1.56295534999968e-11 -1.43384298464281e-09 ] [ -4.923621776942622e-10 1.016987226049719e-09 7.320263329737667e-10 ] [ -2.037669552070433e-09 -3.466982382280607e-09 3.429767824514372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.241034074190157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.204277164566529e-18 } }