Timothy C Berkelbach

43PUBLICATIONS
149CO-AUTHORS
Quantum computationTheoretical quantum chemistryMetal cluster chemistryPhotonics, optoelectronics and optical communicationsFormal methods for software
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Publications (43)

|Oct 12, 2026
High-performance parallel implementation of spin-free high-order coupled-cluster theories.

|Oct 06, 2026
Adsorption energies and decomposition barrier heights for ethylene carbonate on the surface of lithium from cluster-based quantum chemistry.

|Oct 01, 2026
Solid-State Point Defects through a Molecular Lens.

|Sep 19, 2026
Heteroleptic Cr4+ molecular color center candidates.

|Sep 10, 2026
The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project.

|Apr 16, 2026
Markov State Models for Tracking Reaction Dynamics on Catalytic Nanoparticles.

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Frequent Collaborators

15 joint publications

Hong-Zhou Ye

5 joint publications

Xiao Wang

4 joint publications

Samuel M Greene

3 joint publications

Sohang Kundu