Publications by authors named "Ajay Melekamburath"
To follow up on the unexpectedly good performance of several coupled-cluster models with approximate inclusion of 3-body clusters [Rishi, V.; Valeev, E. F.
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- Recent research has focused on twistronics in bilayer graphene, highlighting superconducting phases at magic angles, but theoretical studies face challenges due to costly computations.
- To overcome this, empirical force field approaches that account for anisotropic interlayer interactions are gaining popularity as effective alternatives.
- The study introduces new atomistic empirical potentials, including an improved Lennard-Jones potential and Hod's interlayer potential, calibrated against DFT calculations, to better describe interlayer stacking, sliding, and twisting in bilayer graphynes.