{ "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" [ [ -5.552903299999999 4.427776399999999 -3.3234235999999986 ] [ 5.3878794999999995 3.8822774999999994 3.7159196999999984 ] [ 0.16213329999999998 3.8496020999999994 -7.862370899999997 ] [ 1.4323105999999999 -1.5260484999999997 -4.149820799999998 ] [ -95.59802369999998 86.63568369999999 105.22901009999995 ] [ -3.3617574999999995 -8.836107999999998 2.457578399999999 ] [ 2.4136480999999996 0.08082739999999998 6.018783899999997 ] [ 95.11671299999999 -88.51401059999999 -102.08567679999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.896731918121488e-09 7.094079888656635e-09 -5.32471163680416e-09 ] [ 8.632334641707601e-09 6.220094297203933e-09 5.953559717160287e-09 ] [ 2.597661848533121e-10 6.167742534817329e-09 -1.259690694382154e-08 ] [ 2.29481457595052e-09 -2.444999249050748e-09 -6.648745921047184e-09 ] [ -1.531649198287182e-07 1.388056680947546e-07 1.685954612011699e-07 ] [ -5.386129315674254e-09 -1.415700577310047e-08 3.937474688703104e-09 ] [ 3.867090588518495e-09 1.294997716669715e-10 9.643154929675386e-09 ] [ 1.52393775071484e-07 -1.418150795649483e-07 -1.635592860350358e-07 ] ] } "unrelaxed-potential-energy" { "source-value" -13.659997 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.18857280139101e-18 } }