Standard BAND examples (from 2010.02 release)
Save a file as *.run and run from within Unix shell
- BN zincblende structure (force calculation)
- CO + H2: fine tuning the basis defaults
- BeO
- Beta iron
- CO chain
- Polymer
- Copper dimer - confinement and tails options
- response of Cu within ALDA
- Cu slab
- DIAMOND
- The CO fragment
- Dispersion energy with two parallel graphene sheets
- H2 bulk geometry optimization
- H2 slab frequency calculation near minimum
- H2onLiPartialTS
- H2-chain
- H2-chain
- Hydrogen on platinum
- Formation energy of the H-atom w.r.t. spherical atom
- HELIUM CUBIC
- Hydrogen on Perovksite wit solvation
- Li2O bulk (fluorite structure)
- Li bulk
- NaCl (from neutral atoms)
- NaCl (from charged atoms)
- Ne matrix 4.2 K
- Surface alloy: Cu slab with one surface Cu replaced by Ni (1:1)
- He Atom, with artificial spin polarization
- PE
- Pd bulk
- Platinum slab
- B chain
- Silicon
- SnO EFG
- Three hydrogens wit spin flip
- tif3
- tif3