{ "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" [ [ -0.029423999999999995 1.4155027999999998 -1.1211994999999995 ] [ 0.3063604999999999 2.2395194999999997 -0.2263794999999999 ] [ 0.28474599999999994 -1.0374029999999999 -0.8249492999999997 ] [ -0.5125506999999999 -0.9320406999999999 -0.29419299999999987 ] [ -1.7819969999999998 3.7987212999999995 2.5580736999999987 ] [ -0.021188799999999997 -1.1229033999999998 1.4587748999999994 ] [ -0.024518799999999997 -0.8435631999999998 0.18471089999999993 ] [ 1.7785727999999998 -3.5178331999999997 -1.7348381999999993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.714244527881599e-11 2.267885511521575e-09 -1.796359640952482e-09 ] [ 4.908436346805568e-10 3.588105814287362e-09 -3.626999453166028e-10 ] [ 4.562133878249639e-10 -1.662102846641502e-09 -1.321714492694656e-09 ] [ -8.211967552803436e-10 -1.493293831477004e-09 -4.713491504863618e-10 ] [ -2.855073955258097e-09 6.086222505938103e-09 4.098485910189923e-09 ] [ -3.394820026249919e-11 -1.799089589719155e-09 2.337215059045686e-09 ] [ -3.928344845371919e-11 -1.351537248342268e-09 2.959394880251104e-10 ] [ 2.849587782027955e-09 -5.636190155349448e-09 -2.779517227810617e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.14366 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.630635088524043e-18 } }