{ "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" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.21533470000000005 -1.2248985000000001 0.5149312000000001 ] [ -0.8341682000000002 0.6228349000000001 1.1175184000000002 ] [ 0.5513028000000001 -0.21003140000000006 -0.5287680000000001 ] [ -0.5347942000000001 1.9410871000000005 -1.6052172000000005 ] [ -0.33316550000000006 -0.30170690000000006 0.6062373000000001 ] [ -1.4255425000000002 -0.07804600000000002 -0.6558099000000001 ] [ 0.24786830000000007 -2.0197831000000006 -0.8604719000000002 ] [ 2.1131646000000006 1.2705439000000003 1.4115802000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.450042219869818e-10 -1.962503739552989e-09 8.250107299604892e-10 ] [ -1.336484787854819e-09 9.97891515398306e-10 1.790461853793823e-09 ] [ 8.832844571415783e-10 -3.365073987138932e-10 -8.471797274271746e-10 ] [ -8.568347641794395e-10 3.109964370556473e-09 -2.571841469146038e-09 ] [ -5.337899749571425e-10 -4.833877415140437e-10 9.712992287169161e-10 ] [ -2.283970865456784e-09 -1.250434765469568e-10 -1.050723289469186e-09 ] [ 3.971287952974408e-10 -3.23604926190695e-09 -1.378627961035356e-09 ] [ 3.385662918022185e-09 2.035635732280053e-09 2.261600794824188e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.515683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.530022035354401e-18 } }