News 2007

Nov09: Alchemical predictions Image placeholder Accurate analytical predictions can be made for changes of ab initio energies due to alchemical mutations. Read the article

Aug09: Truman Colloquium presentation on recent progress made.

Aug09: Path-Integral Ab Initio Molecular Dynamics of proton transfer in FI-FA dimer. Watch the movie generated from CSRI summer-student Alejandro Perez-Paz' (NYU, Tuckerman group) trajectories. View Alejandro's quantum group seminar talk.

Jul09: Navigating Chemical Compound Space 2011 Image placeholder workshop homepage is up at IPAM, get the corresponding poster.

May09: Ab initio alchemy Image placeholder Reversible growth of ions permits calculation of hydration from scratch. Read the article