Tutorial exercises
==================

hf-dft

b3lyp:              Shows how to perform a single point energy, geometry optimization and frequency calculation
combined:           Shows how to perform single point energy calculations with various exchange-correlation functionals
restart:            Shows how to restart a calculation
files:              Shows how to use the scratch and permanent directories
multiplicity:       Shows how to set the multiplicity in a calculation
convergence:        Shows how to specify other useful keywords in the dft block
ecp:                Shows how to use effective core potentials (ECP)
direct:             Shows how to perform direct calculations
densityfitting:     Shows how to use charge density fitting basis sets
sodft:              Shows how to perform calculation with a spin-orbit effective core potential
explicitbasis:      Shows how to specify the basis explicitly
multiplestructures: Shows how to specify multiple structures
multiplebasis:      Shows how to specify multiple basis sets 
animate:       

tddft
h2o,2h2o,ethane,butane

properties

mp2

mp2_si2h6_opt:      Geometry optimization using regular MP2
mp2_si2h6_ri_opt:   Geometry optimization using RI-MP2 otherwise the same
                    as above
