{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6296.1703658 -1724.6742949 -687.5188845 ] [ 48.2056658 0.8884551 -49.4552774 ] [ -150.1618601 25.9508719 -14.3999127 ] [ -80.4386725 -45.8989004 117.2074113 ] [ 6341.1082647 1141.9756868 896.6430993 ] [ 137.456968 601.7581815 -262.476436 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.008757704376799e-05 -2.763232856549205e-06 -1.101526692179645e-06 ] [ 7.723399137117292e-08 1.423462001578133e-09 -7.923608987826827e-08 ] [ -2.405858235701969e-07 4.157788059010717e-08 -2.307120365957985e-08 ] [ -1.288769615494784e-07 -7.353814574717326e-08 1.877869757164875e-07 ] [ 1.015957549536663e-05 1.829646761987062e-06 1.436580622735802e-06 ] [ 2.202303423100857e-07 9.641228977176308e-07 -4.205336127347964e-07 ] ] } "unrelaxed-potential-energy" { "source-value" -41.19971995117186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.600922863311117e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6296.1703658 -1724.6742949 -687.5188845 ] [ 48.2056658 0.8884551 -49.4552774 ] [ -150.1618601 25.9508719 -14.3999127 ] [ -80.4386725 -45.8989004 117.2074113 ] [ 6341.1082647 1141.9756868 896.6430993 ] [ 137.456968 601.7581815 -262.476436 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.008757704376799e-05 -2.763232856549205e-06 -1.101526692179645e-06 ] [ 7.723399137117292e-08 1.423462001578133e-09 -7.923608987826827e-08 ] [ -2.405858235701969e-07 4.157788059010717e-08 -2.307120365957985e-08 ] [ -1.288769615494784e-07 -7.353814574717326e-08 1.877869757164875e-07 ] [ 1.015957549536663e-05 1.829646761987062e-06 1.436580622735802e-06 ] [ 2.202303423100857e-07 9.641228977176308e-07 -4.205336127347964e-07 ] ] } "relaxed-potential-energy" { "source-value" -41.19971995117186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.600922863311117e-18 } }