Accessing position space wave functions in band structure calculations of periodic systems - a generalized, adapted numerov implementation for one-, two-, and three-dimensional quantum problems
J. Gamper, F. Kluibenschedl, A.K.H. Weiss, T.S. Hofer, Journal of Physical Chemistry Letters 14 (2023) 7395–7403.

Designing long and highly conducting molecular wires with multiple nontrivial topological states
L. Li, C. Nuckolls, L. Venkataraman, The Journal of Physical Chemistry Letters 14 (2023) 5141–5147.

Bond polarizability as a probe of local crystal fields in hybrid lead-halide perovskites
Y. Wei, A. Volosniev, D. Lorenc, A.A. Zhumekenov, O.M. Bakr, M. Lemeshko, Z. Alpichshev, The Journal of Physical Chemistry Letters 14 (2023) 6309–6314.

Probing charge transport through peptide bonds
J.M. Brisendine, S. Refaely-Abramson, Z.-F. Liu, J. Cui, F. Ng, J.B. Neaton, R.L. Koder, L. Venkataraman, The Journal of Physical Chemistry Letters 9 (2018) 763–767.

Probing the conductance of the <3-system of bipyridine using destructive interference
A. Borges, E.-D. Fung, F. Ng, L. Venkataraman, G.C. Solomon, The Journal of Physical Chemistry Letters 7 (2016) 4825–4829.

Nuclear quantum effects in water at the triple point: Using theory as a link between experiments
B. Cheng, J. Behler, M. Ceriotti, The Journal of Physical Chemistry Letters 7 (2016) 2210–2215.

Reliable formation of single molecule junctions with air-stable diphenylphosphine linkers
R. Parameswaran, J.R. Widawsky, H. Vázquez, Y.S. Park, B.M. Boardman, C. Nuckolls, M.L. Steigerwald, M.S. Hybertsen, L. Venkataraman, The Journal of Physical Chemistry Letters 1 (2010) 2114–2119.