{ "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" [ [ 0.12629630000000003 -0.8769898000000003 0.4281365000000001 ] [ -0.6690202000000001 0.35885810000000007 1.0410826000000002 ] [ -0.026290200000000007 0.19813150000000004 -0.8200616000000002 ] [ -0.28788720000000007 1.4772957000000002 -1.3281994000000001 ] [ -0.30981010000000003 -0.20685200000000006 0.29810310000000007 ] [ -1.6026887000000005 0.18783880000000006 -0.18340810000000002 ] [ 0.7427362000000001 -1.7571349000000005 -1.0068388000000001 ] [ 2.0266639000000004 0.6188526000000001 1.5711858000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.023489808206542e-10 -1.405092565816333e-09 6.85950296462541e-10 ] [ -1.071888532114007e-09 5.749540627416354e-10 1.667998215783969e-09 ] [ -4.21215441431868e-11 3.17441659759371e-10 -1.313883533960654e-09 ] [ -4.612461450676849e-10 2.366888652048674e-09 -2.12801004397282e-09 ] [ -4.963705031972034e-10 -3.314134410961681e-10 4.776138213429655e-10 ] [ -2.567790386715836e-09 3.009509363185992e-10 -2.938521723063354e-10 ] [ 1.189994584865951e-09 -2.815240479565927e-09 -1.613133599564599e-09 ] [ 3.247073545551313e-09 9.915111756101485e-10 2.517317176432598e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.025667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.771948189166487e-18 } }