{ "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" [ [ 2.786609 1.867113 1.082186 ] [ 2.283835 1.161691 2.913478 ] [ 2.881264 2.452205 4.60424 ] [ 1.739559 3.43443 2.357326 ] [ 4.554937 2.252479 3.113794 ] [ 4.190396 3.99304 2.000834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.786609e-10 1.867113e-10 1.082186e-10 ] [ 2.283835e-10 1.161691e-10 2.913478e-10 ] [ 2.881264e-10 2.452205e-10 4.60424e-10 ] [ 1.739559e-10 3.43443e-10 2.357326e-10 ] [ 4.554937e-10 2.252479e-10 3.113794e-10 ] [ 4.190396e-10 3.99304e-10 2.000834e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3686721 -0.1518844 -5.8262417 ] [ -2.7463983 -5.7142585 2.7547408 ] [ -0.2881796 1.2539551 2.4910122 ] [ -1.5103364 3.9261011 0.3606919 ] [ 3.8794597 -1.213482 1.3264352 ] [ -0.7032175 1.8995686 -1.1066384 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.19285444016124e-09 -2.433456347442355e-10 -9.334668238870046e-09 ] [ -4.400215147664865e-09 -9.155251373907675e-09 4.413581306123889e-09 ] [ -4.617146177114957e-10 2.009057544752926e-09 3.991041508967574e-09 ] [ -2.419825669623237e-09 6.290307393317162e-09 5.778921294919315e-10 ] [ 6.215579632675782e-09 -1.944212490161626e-09 2.125183466446172e-09 ] [ -1.126678637837424e-09 3.043444400525787e-09 -1.773030172159519e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8017554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.410196672388015e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.341348 2.1009879 1.0733448 ] [ 2.8687747 0.7291042 2.8196118 ] [ 2.4525831 2.5601447 4.3837995 ] [ 1.9251589 3.9320291 2.6375328 ] [ 4.6880803 2.2334052 3.4519187 ] [ 4.160655 3.6052869 1.7056504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.341348e-10 2.1009879e-10 1.0733448e-10 ] [ 2.8687747e-10 7.291042000000001e-11 2.8196118e-10 ] [ 2.4525831e-10 2.5601447e-10 4.3837995e-10 ] [ 1.9251589e-10 3.9320291e-10 2.6375328e-10 ] [ 4.688080300000001e-10 2.2334052e-10 3.4519187e-10 ] [ 4.160655000000001e-10 3.6052869e-10 1.7056504e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 -3.4e-06 1.6e-06 ] [ -2.2e-06 7e-07 -2.2e-06 ] [ 7e-07 3e-07 -0.0 ] [ -1.6e-06 2e-07 -5e-07 ] [ 1.8e-06 -1.1e-06 1.2e-06 ] [ 1.9e-06 3.3e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 -5.44740051072e-15 2.56348259328e-15 ] [ -3.52478856576e-15 1.12152363456e-15 -3.52478856576e-15 ] [ 1.12152363456e-15 4.8065298624e-16 0.0 ] [ -2.56348259328e-15 3.2043532416e-16 -8.010883104e-16 ] [ 2.88391791744e-15 -1.76239428288e-15 1.92261194496e-15 ] [ 3.04413557952e-15 5.28718284864e-15 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }