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7 Publications
2023 | Published | Journal Article | IST-REx-ID: 14261 | 
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.
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J. Gamper, F. Kluibenschedl, A.K.H. Weiss, T.S. Hofer, Journal of Physical Chemistry Letters 14 (2023) 7395–7403.
2023 | Published | Journal Article | IST-REx-ID: 17861
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.
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L. Li, C. Nuckolls, L. Venkataraman, The Journal of Physical Chemistry Letters 14 (2023) 5141–5147.
2023 | Published | Journal Article | IST-REx-ID: 13251 |
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.
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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.
2018 | Published | Journal Article | IST-REx-ID: 17934 |
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.
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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.
2016 | Published | Journal Article | IST-REx-ID: 17954
Probing the conductance of the σ-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.
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A. Borges, E.-D. Fung, F. Ng, L. Venkataraman, G.C. Solomon, The Journal of Physical Chemistry Letters 7 (2016) 4825–4829.
2016 | Published | Journal Article | IST-REx-ID: 9681
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.
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B. Cheng, J. Behler, M. Ceriotti, The Journal of Physical Chemistry Letters 7 (2016) 2210–2215.
2010 | Published | Journal Article | IST-REx-ID: 18023
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.
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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.