{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.21631e-10 0.0 0.0 ] "source-value" [ 5.21631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] "source-value" [ 0.340777 5.491 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] "source-value" [ 0.0764414 0.261433 5.31631 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.060081614420035e-08 -7.414363924918752e-08 2.17422038906009e-08 ] [ 2.277636179533465e-09 -6.531579330861096e-09 2.838324296688908e-09 ] [ 2.096016962588143e-09 -7.264523384572246e-09 4.475026381708189e-09 ] [ 4.526670141814746e-09 -4.583139978338477e-10 -4.792938437908092e-09 ] [ -3.658470978646311e-09 5.693577511988513e-09 1.363626941552467e-09 ] [ -4.73076143997811e-08 6.483366808227412e-08 -2.474239336758898e-08 ] [ -9.453626488393546e-09 1.477475641549272e-08 6.170865767107171e-09 ] [ -9.08142756131575e-09 3.096053952699362e-09 -7.054715472160569e-09 ] ] "source-value" [ [ 37.8240547 -46.2768201 13.5704164 ] [ 1.4215887 -4.0766912 1.7715427 ] [ 1.3082309 -4.5341589 2.7930918 ] [ 2.8253253 -0.2860571 -2.9915169 ] [ -2.283438 3.5536516 0.851109 ] [ -29.5270907 40.4659931 -15.4429874 ] [ -5.9004896 9.2216777 3.8515515 ] [ -5.6681813 1.9324049 -4.4032071 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.565806714833088e-18 "source-value" -9.7729969 } }