{ "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" [ 5.44335 0 0 ] "si-unit" "m" "si-value" [ 5.44335e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0871492 5.32556 0 ] "si-unit" "m" "si-value" [ 8.71492e-12 5.32556e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0678412 -0.0738369 5.55618 ] "si-unit" "m" "si-value" [ 6.784120000000001e-12 -7.38369e-12 5.556180000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0586252 0.00658789 -0.0562217 ] [ 1.37481 1.15024 1.36711 ] [ 0.0858543 2.81471 2.72056 ] [ 1.52563 4.03682 4.13778 ] [ 2.84739 -0.239071 2.58831 ] [ 4.11503 1.39706 3.91123 ] [ 2.74645 2.72703 -0.0478687 ] [ 4.08136 4.16337 1.33715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.86252e-12 6.58789e-13 -5.62217e-12 ] [ 1.37481e-10 1.15024e-10 1.36711e-10 ] [ 8.58543e-12 2.81471e-10 2.72056e-10 ] [ 1.52563e-10 4.03682e-10 4.13778e-10 ] [ 2.84739e-10 -2.39071e-11 2.58831e-10 ] [ 4.11503e-10 1.39706e-10 3.91123e-10 ] [ 2.74645e-10 2.72703e-10 -4.786870000000001e-12 ] [ 4.08136e-10 4.16337e-10 1.33715e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.017802999999999996 1.3562751999999998 -0.7909515999999996 ] [ 0.38071379999999994 1.4774302999999998 -0.4518627999999998 ] [ 0.016626899999999997 -0.8226583999999999 -0.5127217999999998 ] [ -0.35904959999999997 -1.0028498999999997 -0.17676879999999992 ] [ -2.0780002999999994 3.4556705999999995 2.366514399999999 ] [ 0.20658589999999996 -0.7152140999999999 1.2968735999999994 ] [ -0.08194859999999998 -0.6558769999999999 0.2204390999999999 ] [ 1.9328748999999998 -3.0927765999999997 -1.9515220999999991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.852355061510199e-11 2.172992434713676e-09 -1.267244172144914e-09 ] [ 6.099707546013491e-10 2.36710430502361e-09 -7.239640199338148e-10 ] [ 2.663923067585459e-11 -1.318044066243825e-09 -8.214708877024207e-10 ] [ -5.752608795670463e-10 -1.606742677189236e-09 -2.832148409802191e-10 ] [ -3.329323526104989e-09 5.536594690120759e-09 3.791574075704528e-09 ] [ 3.309871018938605e-10 -1.145899319327339e-09 2.077820579171461e-09 ] [ -1.312961321090124e-10 -1.050830804178018e-09 3.531823752399892e-10 ] [ 3.096807001225086e-09 -4.955174402701963e-09 -3.12668310935461e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.255391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.648536368273389e-18 } }