Applications
References
- Minima hopping: An efficient search method for the global minimum of the potential energy surface of complex molecular systems
- Crystal structure prediction using the minima hopping method
- A Particle-Particle, Particle-Density (P3D) algorithm for the calculation of electrostatic interactions of particles with slab-like geometry
- An enhanced splined saddle method
- Highly accurate and efficient algorithm for electrostatic interaction of charged particles confined by metallic parallel plates
- Interatomic potentials for ionic systems with density functional accuracy based on charge densities obtained by a neural network
Contact Us
-