3.1.5. horton.exceptions – Definition of all excpetions in HORTON

exception horton.exceptions.ElectronCountError

Bases: exceptions.ValueError

Exception raised when a negative number of electron is encountered, or when more electrons than basis functions are requested.

args
message
exception horton.exceptions.NoSCFConvergence

Bases: exceptions.Exception

Exception raised when an SCF algorithm does not reach the convergence threshold in the specified number of iterations

args
message
exception horton.exceptions.SymmetryError

Bases: exceptions.Exception

Exception raised when some symmetry algorithm fails

args
message