{ "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" [ [ -0.15118539999999997 2.5168297999999996 -1.1600436999999995 ] [ 0.43256239999999996 2.8734836999999995 -0.6901317999999996 ] [ 0.25258339999999996 -1.6913578999999999 -1.0364212999999995 ] [ -0.5966696999999999 -2.0733294999999994 -0.30436449999999987 ] [ -4.815126099999999 7.8818288999999995 5.250508099999998 ] [ 0.5036276999999999 -1.4372179999999999 2.167804199999999 ] [ -0.30245759999999994 -0.9752265999999999 0.16987919999999992 ] [ 4.676665299999999 -7.095010399999999 -4.397230199999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.422257132862963e-10 4.032405864092739e-09 -1.858594895246328e-09 ] [ 6.930413643171379e-10 4.603828404389881e-09 -1.105713035230621e-09 ] [ 4.046832182821747e-10 -2.709854084785384e-09 -1.660529976159142e-09 ] [ -9.559702436797495e-10 -3.321840052114953e-09 -4.876456861014813e-10 ] [ -7.714682463623882e-09 1.262808199272578e-08 8.412241325141025e-09 ] [ 8.06900526527276e-10 -2.302677078592934e-09 3.473205207712046e-09 ] [ -4.84590495503278e-10 -1.562485258502273e-09 2.721764826002072e-10 ] [ 7.492843806966617e-09 -1.136745978721286e-08 -7.045139422715706e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.681837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.075989854539641e-18 } }