{ "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" [ [ -0.5631283999999999 1.4803418999999998 -1.3298182999999992 ] [ -0.18781089999999998 1.5205170999999997 0.10895559999999996 ] [ 0.9508472999999998 -0.6789710999999999 -0.4790993999999998 ] [ -0.16742469999999998 -0.10234509999999998 0.46561829999999976 ] [ -1.8656198999999998 2.0566758999999997 2.9598407999999985 ] [ -0.07117189999999998 -0.08455819999999999 0.5014639999999998 ] [ -0.28014849999999997 -1.7625091999999998 0.4990854999999998 ] [ 2.1844569999999996 -2.4291512999999996 -2.7260463999999986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.022311569885105e-10 2.371769182970651e-09 -2.130603790172e-09 ] [ -3.009062331114067e-10 2.436136949146615e-09 1.745661150252364e-10 ] [ 1.523425314010804e-09 -1.087831622618859e-09 -7.676018577193073e-10 ] [ -2.682439400844538e-10 -1.63974926473438e-10 7.460027544766402e-10 ] [ -2.989052587079234e-09 3.295158043542798e-09 4.742187731049967e-09 ] [ -1.140299542379155e-10 -1.354771711369305e-10 8.034338969728509e-10 ] [ -4.488473770521888e-10 -2.823851034184911e-09 7.99623119880278e-10 ] [ 3.499885934542905e-09 -3.891929421245926e-09 -4.367607809296003e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 152.39122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.441576498991894e-17 } }