{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.3416682 -6.2639455 0.8673429 ] [ 2.067524 -3.959136 4.0749969 ] [ 0.926675 -3.9860279 1.4825858 ] [ 2.1606659 1.5527201 -1.4022427 ] [ -2.8268795 2.4880334 -0.1234762 ] [ -5.2479198 6.4208641 -3.3182865 ] [ -0.4560441 3.4457301 -1.2139962 ] [ -3.9656897 0.3017618 -0.366924 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.176264914771082e-08 -1.003594703406537e-08 1.389636516596872e-09 ] [ 3.3125386157429e-09 -6.343235137767629e-09 6.528864763012477e-09 ] [ 1.48469702007984e-09 -6.38632071123652e-09 2.375364307090065e-09 ] [ 3.461768390339791e-09 2.487731842866238e-09 -2.246640470627468e-09 ] [ -4.529160244718794e-09 3.986268945249535e-09 -1.97830680865225e-10 ] [ -8.408094411393412e-09 1.028735834635403e-08 -5.31648105141626e-09 ] [ -7.306631950737773e-10 5.520668207806846e-09 -1.945036329380041e-09 ] [ -6.353735322687366e-09 4.834757010105256e-10 -5.878770544104192e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 173.13441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.773919039580017e-17 } }