Timothy C. Berkelbach, Ph.D.

Affiliations: 
2014 Chemical Physics Columbia University, New York, NY 
Area:
chemistry, physics, and biology of disordered materials
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Parents

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David R. Reichman grad student 2014 Columbia
 (Microscopic theories of excitons and their dynamics.)
Garnet K.L. Chan post-doc 2014-2016 Princeton
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Publications

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Kurian JS, Ye HZ, Mahajan A, et al. (2023) Toward Linear Scaling Auxiliary-Field Quantum Monte Carlo with Local Natural Orbitals. Journal of Chemical Theory and Computation. 20: 134-142
Neufeld VA, Berkelbach TC. (2023) Highly Accurate Electronic Structure of Metallic Solids from Coupled-Cluster Theory with Nonperturbative Triple Excitations. Physical Review Letters. 131: 186402
Chen MS, Lee J, Ye HZ, et al. (2023) Data-Efficient Machine Learning Potentials from Transfer Learning of Periodic Correlated Electronic Structure Methods: Liquid Water at AFQMC, CCSD, and CCSD(T) Accuracy. Journal of Chemical Theory and Computation
Neufeld VA, Ye HZ, Berkelbach TC. (2022) Ground-State Properties of Metallic Solids from Ab Initio Coupled-Cluster Theory. The Journal of Physical Chemistry Letters. 13: 7497-7503
Lau BTG, Knizia G, Berkelbach TC. (2021) Regional Embedding Enables High-Level Quantum Chemistry for Surface Science. The Journal of Physical Chemistry Letters. 1104-1109
Lange MF, Berkelbach TC. (2020) Active space approaches combining coupled-cluster and perturbation theory for ground states and excited states. Molecular Physics. 118
Greene SM, Webber RJ, Weare J, et al. (2020) Improved Fast Randomized Iteration Approach to Full Configuration Interaction. Journal of Chemical Theory and Computation
Sun Q, Zhang X, Banerjee S, et al. (2020) Recent developments in the PySCF program package. The Journal of Chemical Physics. 153: 024109
Lau BTG, Berkelbach TC. (2020) Quantum plasmons and intraband excitons in doped nanoparticles: Insights from quantum chemistry. The Journal of Chemical Physics. 152: 224704
Wang X, Berkelbach TC. (2020) Excitons in solids from periodic equation-of-motion coupled-cluster theory. Journal of Chemical Theory and Computation
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