Navigation : Manual Input Variables - Atomic Orbitals - Calculation Modes -- Geometry Optimization -- Invert KS -- Optimal Control -- Test -- Unoccupied States --- UnoccShowOccStates --- UnoccUseTD -- CalculationMode - ClassicalParticles - DFTBPlusInterface - Execution - Hamiltonian - Linear Response - Math - Maxwell - MaxwellStates - Mesh - Output - SCF - States - System - Time-Dependent - Utilities - Alphabetic Index Tutorials Developers Releases UnoccShowOccStates A - B - C - D - E - F - G - H - I - K - L - M - N - O - P - Q - R - S - T - U - V - W - X UnoccShowOccStates Section Calculation Modes::Unoccupied States Type logical Default false If true, the convergence for the occupied states will be shown too in the output. This is useful for testing, or if the occupied states fail to converge. It will be enabled automatically if only occupied states are being calculated. Source information scf/unocc.F90 : 116 call parse_variable(sys%namespace, 'UnoccShowOccStates', .false., showoccstates)