{ "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" [ [ -2.3003312999999994 3.5682176999999995 -3.3994898999999985 ] [ 1.4935676999999998 3.7508444999999995 -1.3722204999999994 ] [ 0.43023369999999994 -1.0557886999999997 -1.1103765999999995 ] [ -0.31137549999999997 -0.8714588999999999 -0.42144469999999984 ] [ -5.559054599999999 6.805629899999999 6.359750899999997 ] [ 2.0606111999999994 -3.3687055999999997 3.8300482999999983 ] [ -1.2985445999999998 -2.2789470999999994 1.6546225999999993 ] [ 5.484893399999999 -6.5497917999999995 -5.540889999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.685537059318843e-09 5.716915023965221e-09 -5.446583285298993e-09 ] [ 2.392959270237121e-09 6.009515415667411e-09 -2.198539621795796e-09 ] [ 6.893103812993656e-10 -1.691559985581235e-09 -1.779019443460363e-09 ] [ -4.98878550500067e-10 -1.396231087071342e-09 -6.752288508631394e-10 ] [ -8.906587387250213e-09 1.090382120543175e-08 1.018944429004047e-08 ] [ 3.301463116398699e-09 -5.397261399144949e-09 6.136413893351419e-09 ] [ -2.080497816326876e-09 -3.65127579374206e-09 2.650997667808327e-09 ] [ 8.787768045460812e-09 -1.04939233795248e-08 -8.877484489564254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.414009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.51373211020657e-18 } }