{ "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" [ [ -0.30474889999999993 1.3180645999999998 -0.9898377999999995 ] [ 0.28204999999999997 1.9165907999999998 -0.07116909999999997 ] [ 0.2955903999999999 -0.8794245999999999 -0.7501758999999997 ] [ -0.22070919999999997 -0.6449755999999999 -0.2278234999999999 ] [ -4.063322099999999 4.7372781999999996 4.8919457999999985 ] [ 0.0033057999999999994 -0.8475947999999999 1.1881087999999995 ] [ -0.10242359999999999 -0.9875782999999999 0.2560988999999999 ] [ 4.110257599999999 -4.612360399999999 -4.297147099999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.882615668172025e-10 2.111772304222556e-09 -1.585894994609964e-09 ] [ 4.518939196196999e-10 3.070716996699367e-09 -1.140254690828093e-10 ] [ 4.735880321147134e-10 -1.408993545484796e-09 -1.20191429836992e-09 ] [ -3.536151231488327e-10 -1.03336483582013e-09 -3.650134883760988e-10 ] [ -6.510159725035809e-09 7.589956440797578e-09 7.837761255554435e-09 ] [ 5.296475516677199e-12 -1.357996583659903e-09 1.903560158009779e-09 ] [ -1.641006986901623e-10 -1.582274876505442e-09 4.103156735731024e-10 ] [ 6.585358686440917e-09 -7.389816060466892e-09 -6.884788676480859e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.71355707419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.959548368729287e-18 } }