{ "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" [ [ 38.2763828 -44.2162407 10.6886653 ] [ -0.6757612 -3.6593166 0.6046111 ] [ -1.8281504 -1.6150752 0.8424277 ] [ 0.4124589 1.5153649 -5.1990762 ] [ -1.8247954 2.8126036 1.6555467 ] [ -36.668566 45.7596788 -13.5636502 ] [ 5.2023284 -1.0869489 6.2415511 ] [ -2.893897 0.4899342 -1.2700756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.13255261561995e-08 -7.084222769285979e-08 1.71251297923066e-08 ] [ -1.082688804803801e-09 -5.862871552928323e-09 9.686937770770373e-10 ] [ -2.929019854317754e-09 -2.587635747592876e-09 1.349717976774361e-09 ] [ 6.608320120653425e-10 2.427882234763746e-09 -8.32983840602551e-09 ] [ -2.923644551710683e-09 4.506287768624282e-09 2.652478239235807e-09 ] [ -5.874951964748684e-08 7.331508815270516e-08 -2.173136342218943e-08 ] [ 8.335049004874604e-09 -1.741484129932003e-09 1.0000067332337e-08 ] [ -4.636534154602698e-09 7.849611274374827e-10 -2.03488544973353e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.56051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.332850890112334e-18 } }