{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.5199532e-10 3.0277475e-10 2.9851182e-10 ] [ 4.2903432e-10 3.1214286e-10 1.1413408e-10 ] [ 3.8114617e-10 6.337939e-11 3.301398e-10 ] ] "source-value" [ [ 1.5199532 3.0277475 2.9851182 ] [ 4.2903432 3.1214286 1.1413408 ] [ 3.8114617 0.6337939 3.301398 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.8469775114368e-13 -1.8553205268864e-13 -4.9234887557184e-13 ] [ -9.2750004578112e-13 -7.836245852332801e-13 1.17776003395008e-12 ] [ -5.703748770048e-14 9.689964202598399e-13 -6.8541115837824e-13 ] ] "source-value" [ [ 0.0006146 -0.0001158 -0.0003073 ] [ -0.0005789 -0.0004891 0.0007351 ] [ -3.56e-05 0.0006048 -0.0004278 ] ] } "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" -9.499913210750793e-19 "source-value" -5.9293795 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.869279778520858e-08 -2.713340788010691e-07 2.397405607875719e-07 ] [ 3.749758791979335e-07 3.104642664006006e-07 -4.714219363708153e-07 ] [ -3.162830814127249e-07 -3.913018759953154e-08 2.31681375743461e-07 ] ] "source-value" [ [ -36.6331633 -169.3534129 149.6342898 ] [ 234.0415372 193.7765552 -294.2384318 ] [ -197.4083739 -24.4231423 144.6041421 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.006720662146081e-17 "source-value" 62.834562 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.987433e-10 2.877912e-10 2.797409e-10 ] [ 3.916588e-10 2.799592e-10 1.620454e-10 ] [ 3.717737e-10 1.105466e-10 3.009994e-10 ] ] "source-value" [ [ 1.987433 2.877912 2.797409 ] [ 3.916588 2.799592 1.620454 ] [ 3.717737 1.105466 3.009994 ] ] } "instance-id" 1 }