{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7988983 0.4673865 0.2218489 ] [ 0.3258309 0.1815657 2.151485 ] [ 0.290514 2.993692 1.621534 ] [ 2.152844 0.6900228 1.637351 ] [ 2.682916 2.279137 0.4360972 ] [ 1.831466 2.039249 2.911237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.988983e-11 4.673865e-11 2.218489e-11 ] [ 3.258309e-11 1.815657e-11 2.151485e-10 ] [ 2.90514e-11 2.993692e-10 1.621534e-10 ] [ 2.152844e-10 6.900228e-11 1.637351e-10 ] [ 2.682916e-10 2.279137e-10 4.360972e-11 ] [ 1.831466e-10 2.039249e-10 2.911237e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1702336 -6.8022047 -17.473889 ] [ -13.5296873 -10.3633867 8.0410558 ] [ -9.3916872 13.3968933 0.0280036 ] [ 20.0846682 -14.1234249 1.5959046 ] [ 8.2673847 7.5785139 -9.5010881 ] [ 2.7395552 10.313609 17.3100132 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.309015726039462e-08 -1.089833334023588e-08 -2.799625643025429e-08 ] [ -2.167694867879468e-08 -1.660397588304966e-08 1.288319160930824e-08 ] [ -1.504714166170661e-08 2.146418923661216e-08 4.486671321823488e-11 ] [ 3.217918582656522e-08 -2.262822118040458e-08 2.556921039147176e-09 ] [ 1.324581048149962e-08 1.214211779098783e-08 -1.522242122598109e-08 ] [ 4.389251292831067e-09 1.652422321587247e-08 2.77336984547794e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.913272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.748498925483126e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4407076 0.3379022 -0.0998643 ] [ -0.1420401 0.0759167 2.2076781 ] [ 0.9837672 3.4862497 1.6369496 ] [ 3.3437765 1.0815361 1.9599337 ] [ 2.1375313 2.0187761 0.0162933 ] [ 1.3187268 1.6506721 3.2585627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.407076e-11 3.379022e-11 -9.98643e-12 ] [ -1.420401e-11 7.591670000000001e-12 2.2076781e-10 ] [ 9.837672e-11 3.4862497e-10 1.6369496e-10 ] [ 3.3437765e-10 1.0815361e-10 1.9599337e-10 ] [ 2.1375313e-10 2.0187761e-10 1.62933e-12 ] [ 1.3187268e-10 1.6506721e-10 3.2585627e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.6e-06 -9.7e-06 7e-07 ] [ 4.9e-06 4.5e-06 0.0 ] [ 3.9e-06 -3e-07 -2e-06 ] [ -1.08e-05 5.1e-06 -5.4e-06 ] [ 1.16e-05 7.4e-06 -2.6e-06 ] [ -3e-06 -7e-06 9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.057436569728e-14 -1.554111322176e-14 1.12152363456e-15 ] [ 7.850665441919999e-15 7.2097947936e-15 0.0 ] [ 6.24848882112e-15 -4.8065298624e-16 -3.2043532416e-15 ] [ -1.730350750464e-14 8.17110076608e-15 -8.65175375232e-15 ] [ 1.858524880128e-14 1.185610699392e-14 -4.16565921408e-15 ] [ -4.8065298624e-15 -1.12152363456e-14 1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }