Table of Contents
BAND-GUI TutorialTable of Contents
Tutorial 1: with a grain of salt
Step 1: Start BANDinput
Step 2: Create the unit cell
Select the coordinates tab
Select periodicity
Enter lattice vectors
Step 3: Add the atoms
Step 4: Running the calculation
Step 5: Examine the band structure
Step 6: Visualizing the results
Plotting the orbitals
Plotting the deformation density
Step 7: Check the charges
