ADF density functional package for 175 US$/yr



Due to a change in our pricing policy, an academic license for the
 Amsterdam
 Density Functional program (ADF) is now available from 175 US$ per year. This
 includes the molecular ADF code, the periodic structure program ADF-BAND and
 parallelization. Regional and multi-CPU discounts apply.
 Outstanding features of ADF include:
 - analysis of results in terms of user-defined molecular fragments,
 - decomposes energy in chemically useful quantities (steric interaction etc.)
 - highly-optimized, accurate and tunable numerical integration
 - very well suited (i.e. reliable) for transition metal complexes
 - chemistry for gas phase, solvents (COSMO), and solid states
 - inclusion of scalar and spin-orbit relativistic effects
 - high-quality Slater type basis sets for the whole periodic system
 - efficient: well parallellized, uses full molecular symmetry, cut-offs, QM/MM
 - many modern exchange-correlation potential/energy functionals available.
 - molecular properties: NMR, UV/VIS (TDDFT), ESR, IR, Raman, EPR, etc.
 - Automatic transition state search and trace of Intrinsic Reaction Coordinate
 - Advanced charge analysis methods (better than Mulliken)
 - Continuous development in TC groups of Profs. Baerends, Ziegler, and Snijders.
 Please have a look at our website (http://www.scm.com) or contact us
 by E-mail (info ^at^ scm.com) for further information.
 Best regards,
 Stan van Gisbergen, CEO of Scientific Computing & Modelling NV