From the 1 of 4 linked papers with an AI index.
4 papers
Tree Tensor Networks Methods for Efficient Calculation of Molecular Vibrational Spectra
Shuo Sun, Richard M. Milbradt, Stefan Knecht +2
The paper introduces Tree Tensor Networks for calculating molecular vibrational spectra, testing various tree architectures and eigensolvers on high‑dimensional oscillator models a…
Efficient Application of Tensor Network Operators to Tensor Network States
Richard M. Milbradt, Shuo Sun, Christian B. Mendl +2
The performance of tensor network methods has seen constant improvements over the last few years. We add to this effort by introducing a new algorithm that efficiently applies tree…
Protein Folding with Neural Ordinary Differential Equations
Arielle Sanford, Shuo Sun, Christian B. Mendl
Recent advances in protein structure prediction, such as AlphaFold, have demonstrated the power of deep neural architectures like the Evoformer for capturing complex spatial and ev…
Riemannian quantum circuit optimization based on matrix product operators
Isabel Nha Minh Le, Shuo Sun, Christian B. Mendl
We significantly enhance the simulation accuracy of initial Trotter circuits for Hamiltonian simulation of quantum systems by integrating first-order Riemannian optimization with t…