{ "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" [ [ 0.10339380000000002 -0.8997690000000003 0.4035640000000001 ] [ -0.6699984000000001 0.4635170000000001 0.8832474000000002 ] [ -0.0044813000000000006 0.20850250000000006 -0.9284899000000002 ] [ -0.24744250000000007 1.4541779000000001 -1.1765445000000003 ] [ -0.31542970000000004 -0.23535020000000006 0.3858098000000001 ] [ -1.6206912000000004 0.26549880000000003 0.017962200000000005 ] [ 0.7250906000000001 -1.7294292000000004 -1.0060319000000002 ] [ 2.0295587000000004 0.4728523000000001 1.4204829000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.656551290956711e-10 -1.441588855920596e-09 6.465808057965314e-10 ] [ -1.073455772453407e-09 7.426361007433538e-10 1.415118334662387e-09 ] [ -7.179834090791041e-12 3.340578308783521e-10 -1.48760481042893e-09 ] [ -3.964465884923041e-10 2.32984983386404e-09 -1.885032091230826e-09 ] [ -5.053740908459578e-10 -3.770725881406043e-10 6.181354416355239e-10 ] [ -2.596633550176298e-09 4.253759702104551e-10 2.877861689813377e-11 ] [ 1.161723207281845e-09 -2.770851031568848e-09 -1.611840789959004e-09 ] [ 3.251711499681242e-09 7.57592900151508e-10 2.275864492626185e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.289344 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.051799571216875e-18 } }