Publication

Optimal radial basis for density-based atomic representations

Related publications (40)

About
Privacy
Disclaimer

Graph Chatbot

Chat with Graph Search

Ask any question about EPFL courses, lectures, exercises, research, news, etc. or try the example questions below.

DISCLAIMER: The Graph Chatbot is not programmed to provide explicit or categorical answers to your questions. Rather, it transforms your questions into API requests that are distributed across the various IT services officially administered by EPFL. Its purpose is solely to collect and recommend relevant references to content that you can explore to help you answer your questions.

Optimal radial basis for density-based atomic representations

Graph Chatbot

Chat with Graph Search

Efficient Treatment of Correlation Energies at the Basis-Set Limit by Monte Carlo Summation of Continuum States

Deterministic and Statistical Approaches to Quantum Chemistry

Haldane Gap of the Three-Box Symmetric SU(3) Chain

Atom-density representations for machine learning

Shedding Light on the Basis Set Dependence of the Minnesota Functionals: Differences Between Plane Waves, Slater Functions, and Gaussians

Quantum Chemical Investigation of the Transition States and Intermediates for the Reaction of the Nitrosonium Ion with the Pentaammineazidocobalt(III) Ion

Reduced basis method and domain decomposition for elliptic problems in networks and complex parametrized geometries

Exact diagonalization of HeisenbergSU(N)chains in the fully symmetric and antisymmetric representations

Multipole moments for embedding potentials: Exploring different atomic allocation algorithms

MATHICSE Technical Report: Reduced basis method and domain decomposition for elliptic problems in networks and complex parametrized geometries