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In the News..

11-12-2007

Amsterdam Density Functional Package

ADF 2007 software package performs electronic structure calculations using Density Functional Theory (DFT).

New Features

  • Geometry optimizations and TDDFT enhancements for periodic structures in BAND
  • GUI enhancements: remote job control, export movies, more visualization options, surface builder
  • Improved geometry optimization, transition state search, and SCF convergence
  • Vibrational Circular Dichroism spectra
  • MO6 xc energy functionals
  • Parallel Windows desktop version
  • Spin-orbit coupled gradients
The Tommi Melon

ADF Software

Demos


Click here for a FREE trial of ADF & BAND