{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.0226907e-10 2.5492683e-10 2.1338992e-10 ] [ 2.5907247e-10 2.7558261e-10 4.4314255e-10 ] [ 4.6890445e-10 2.0060986e-10 3.6946453e-10 ] ] "source-value" [ [ 3.0226907 2.5492683 2.1338992 ] [ 2.5907247 2.7558261 4.4314255 ] [ 4.6890445 2.0060986 3.6946453 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.6165962103872e-13 -3.012092047104e-14 1.07698312450176e-12 ] [ 8.5684405680384e-13 -3.2412033038784e-13 -1.0358071853472e-12 ] [ -1.01850367784256e-12 3.5424125085888e-13 -4.101572149248001e-14 ] ] "source-value" [ [ 0.0001009 -1.88e-05 0.0006722 ] [ 0.0005348 -0.0002023 -0.0006465 ] [ -0.0006357 0.0002211 -2.56e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.764296065396782e-19 "source-value" -6.0943943 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.156906743924396e-09 -4.043075078645971e-10 -3.414927314871744e-11 ] [ -1.14565722099911e-09 4.306162092841056e-10 1.276533741969414e-09 ] [ -1.12496831429472e-11 -2.630870141950848e-11 -1.242384468820696e-09 ] ] "source-value" [ [ 0.7220844 -0.2523489 -0.0213143 ] [ -0.715063 0.2687695 0.7967497 ] [ -0.0070215 -0.0164206 -0.7754354 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.141940810977395e-19 "source-value" -5.7059507 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.799426e-10 2.62526e-10 2.056934e-10 ] [ 2.71769e-10 2.707942e-10 4.283304e-10 ] [ 4.785344000000001e-10 1.977991e-10 3.919732e-10 ] ] "source-value" [ [ 2.799426 2.62526 2.056934 ] [ 2.71769 2.707942 4.283304 ] [ 4.785344 1.977991 3.919732 ] ] } "instance-id" 1 }