ManagedMethodError

exception psi4.driver.ManagedMethodError(circs)

Error called when a requested level of theory and derivative level are nominally available but not for the particular conditions (e.g., reference, algorithm, active orbitals, QC module, etc.) requested.

Parameters:

circs (List[str]) – List providing calling function name, level of theory, algorithm, reference, QC module, and frozen-core/all-electron requested conditions.

message

Human readable string describing the exception.

Type:

str

stats

Dictionary of conditions for which method request was made. Keys are:

• driver : {“energy”, “gradient”, “hessian”, “properties”}

• derivative_int : {0, 1, 2, “prop”}, integer representation of driver

• method : str, model/method/level-of-theory

• link : str, link address to table in docs

• method_type : (str, str), raw value and str repr of governing variable and algorithm

• reference : (str, str), raw value and str repr of reference type

• qc_module : (str, str), raw value and str repr of targeted implementation

• fcae : (str, str), raw value and str repr of all-electron/frozen-core status

Type:

Dict[str, Any]