CRYSTAL
From MaRDI portal
Software:37347
No author found.
Related Items (9)
Density functional theory method for twisted geometries with application to torsional deformations in group-IV nanotubes ⋮ The Gruneisen parameter for silver azide ⋮ Ab initio calculations of thermodynamic parameters of lithium, sodium and potassium peroxides ⋮ THE ELECTRONIC STRUCTURE AND MAGNETISM OF CrSb WITH LATTICE CONSTANTS ⋮ Implementation of analytical Hartree-Fock gradients for periodic systems ⋮ Tensor Numerical Methods in Quantum Chemistry ⋮ A new approach to the modeling of local defects in crystals: The reduced Hartree-Fock case ⋮ From atoms to crystals: a mathematical journey ⋮ QWalk: A quantum Monte Carlo program for electronic structure
This page was built for software: CRYSTAL