Publications
Translational eigenstates of He@C60 from four-dimensional abĀ initio potential energy surfaces interpolated using Gaussian process regression
– The Journal of chemical physics
(2024)
160,
104303
(doi: 10.1063/5.0197903)
Translational eigenstates of He@C$_{60}$ from four-dimensional
\textit{ab initio} Potential Energy Surfaces interpolated using Gaussian
Process Regression
(2024)
Exploring the parameter space of an endohedral atom in a cylindrical cavity.
– The Journal of Chemical Physics
(2023)
159,
164308
(doi: 10.1063/5.0170010)
Exploring the parameter space of an endohedral atom in a cylindrical
cavity
(2023)