{ "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" [ [ -0.22824439999999996 1.3132007999999997 -0.9559300999999996 ] [ 0.25922519999999993 2.0588082999999995 -0.2478390999999999 ] [ 0.29025129999999993 -0.9092525999999999 -0.8530806999999997 ] [ -0.31205559999999993 -0.8655098999999999 -0.41007239999999984 ] [ -5.324415299999999 6.4530484999999995 6.187106199999997 ] [ 0.07113859999999998 -1.0981156999999997 1.3939434999999993 ] [ -0.007465099999999999 -0.7776271999999999 0.2521704999999999 ] [ 5.251565399999999 -6.174552199999999 -5.366297799999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.656878445213495e-10 2.103979637510107e-09 -1.531568869957282e-09 ] [ 4.153245583839766e-10 3.298574552145261e-09 -3.970820150115892e-10 ] [ 4.65033850848124e-10 -1.456783270123748e-09 -1.366785964456363e-09 ] [ -4.999681908288503e-10 -1.386699738275676e-09 -6.570084175283013e-10 ] [ -8.530653783372099e-09 1.033892352476875e-08 9.912836985716525e-09 ] [ 1.139766026954724e-10 -1.759375315968553e-09 2.233343704816178e-09 ] [ -1.19604087904734e-11 -1.245896129802844e-09 4.040216828840968e-10 ] [ 8.41393537580286e-09 -9.892723260253292e-09 -8.5977569462456e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.619749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.546695292274486e-18 } }