{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44335e-10 0.0 0.0 ] "source-value" [ 5.44335 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.71492e-12 5.32556e-10 0.0 ] "source-value" [ 0.0871492 5.32556 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.784120000000001e-12 -7.38369e-12 5.556180000000001e-10 ] "source-value" [ 0.0678412 -0.0738369 5.55618 ] } "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" [ [ -8.120058623294554e-10 3.233568932280288e-09 -2.199017052315485e-09 ] [ 8.372278073470752e-10 3.932245472208103e-09 -4.568348683775251e-10 ] [ 3.905659594233197e-10 -1.506325443154668e-09 -1.848214873573152e-09 ] [ -5.222192156193868e-10 -1.909193074890151e-09 -5.038831052826413e-10 ] [ -7.482156167382247e-09 1.036123743403938e-08 9.187007956490891e-09 ] [ 3.233226066483437e-10 -2.404027246836177e-09 2.682706003034239e-09 ] [ -3.521633879993645e-10 -1.678234668689632e-09 8.687296438475828e-10 ] [ 7.617428259911716e-09 -1.00292715651748e-08 -7.730493543606248e-09 ] ] "source-value" [ [ -0.5068141999999999 2.0182349999999993 -1.3725184999999993 ] [ 0.5225564999999999 2.4543145999999996 -0.2851338999999999 ] [ 0.24377209999999996 -0.9401743999999999 -1.1535649999999995 ] [ -0.32594359999999994 -1.1916245999999997 -0.3144990999999998 ] [ -4.669994599999999 6.466975799999999 5.734079399999997 ] [ 0.20180209999999998 -1.5004757999999998 1.6744133999999993 ] [ -0.21980309999999997 -1.0474716999999998 0.5422183999999998 ] [ 4.754424799999999 -6.259778999999999 -4.824994599999998 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.518295544449104e-18 "source-value" -34.442492 } }