Our guest on this episode is Professor Gábor Csányi from the University of Cambridge.
Some relevant papers:
- Bartok, A. P., Payne, M. C., Kondor, R., and Csanyi, G., Gaussian
approximation potentials: the accuracy of quantum mechanics, without the electrons. Physical Review Letters, doi:10.1103/PhysRevLett.104.136403
(2010) - Bartok, A. P., Kondor, R., and Csanyi, G., On representing chemical environments. Phys. Rev. B, doi:10.1103/PhysRevB.87.184115 (2013)
- Braams, B. J., and Bowman, J. M., Permutationally invariant potential energy surfaces in high dimensionality. International Reviews in Physical Chemistry, doi:10.1080/01442350903234923 (2009)
