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publications.html
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---
layout: default
title: publications
---
<h1>{{ "Publications" }}</h1>
<img align="center" src="assets/images/jcc.jpg" alt="JCC" width="308" height="405">
<p style="margin: auto; width: 600px; margin-top: 20px; line-height=20px">
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Please see my <a href="https://scholar.google.ca/citations?user=Ys4bssUAAAAJ&hl=en&oi=ao">google scholar</a> page for citation statistics.
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30) D. Castaldo, S. Jahangiri, A. Migliore, J.M. Arrazola, S. Corni, A differentiable quantum phase estimation algorithm, <i>arXiv:</i>2406.14113, 2024
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29) D. Castaldo, S. Jahangiri, A. Delgado, S. Corni, Quantum simulation of molecules in solution,
<i>J. Chem. Theor. Comp.</i>, 18, 7457, 2022
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28) A. Delgado, P. Casares, R. Dos Reis, M.S. Zini, R. Campos, N. Cruz-Hernández, A. Voigt, A. Lowe, S. Jahangiri, M. A. Martin-Delgado, J. E. Mueller, J. M. Arrazola, Simulating key properties of lithium-ion batteries with a fault-tolerant quantum computer, <i>Phys. Rev. A</i>, 106, 032428, 2022
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27) J. Ceroni, A. Delgado, S. Jahangiri, J.M. Arrazola, Tailgating quantum circuits for high-order energy derivatives, <i>arXiv:</i>2207.11274, 2022
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26) J.M. Arrazola, O. Di Matteo, N. Quesada, S. Jahangiri, A. Delgado, N. Killoran, Universal quantum circuits for quantum chemistry, <i>Quantum</i>, 6, 742, 2022
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25) J.M. Arrazola, S. Jahangiri, A. Delgado, J. Ceroni, J. Izaac, A. Száva, U. Azad, R.A. Lang, Z. Niu, O. Di Matteo, R. Moyard, J. Soni, M. Schuld, R.A. Vargas-Hernández, T. Tamayo-Mendoza, C.Y. Lin, A. Aspuru-Guzik, N. Killoran, Differentiable quantum computational chemistry with PennyLane,
<i>arXiv:</i>2111.09967, 2021
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24) A. Delgado, J.M. Arrazola, S. Jahangiri, Z. Niu, J. Izaac, C. Roberts, N. Killoran, Variational quantum algorithm for molecular geometry optimization, <i>Phys. Rev. A</i>, 104, 052402, 2021
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23) J.M. Arrazola, V. Bergholm, K. Bradler, T.R. Bromley, M.J. Collins, I. Dhand, A. Fumagalli, T. Gerrits, A. Goussev, L.G. Helt, J. Hundal, T. Isacsson, R.B. Israel, J. Izaac, S. Jahangiri, R. Janik, N. Killoran, S.P. Kumar, J. Lavoie, A.E. Lita, D.H. Mahler, M. Menotti, B. Morrison1, S.W. Nam, L. Neuhaus, H.Y. Qi, N. Quesada, A. Repingon, K.K. Sabapathy, M. Schuld, D. Su, J. Swinarton, A. Szava1, K. Tan, P. Tan, V.D. Vaidya, Z. Vernon, Z. Zabaneh, and Y. Zhang, Quantum Circuits with Many Photons on a Programmable Nanophotonic Chip, <i>Nature</i>, 591, 54, 2021.
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22) S. Jahangiri, J.M. Arrazola, A. Delgado, Quantum Algorithm for Simulating Single-Molecule Electron Transport, <i>J. Phys. Chem. Lett.</i> 12, 1256, 2021.
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21) S. Tahmasebi, S. Jahangiri, N.J. Mosey, G. Jerkiewicz, A. Mark, S. Cheng, G. Botton, S. Baranton, C.e Coutanceau, Remarkably Stable Nickel Hydroxide Nanoparticles for Miniaturized Electrochemical Energy Storage, <i>ACS Appl. Energy Mater.</i> 3, 7294, 2020.
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20) S. Jahangiri, J.M. Arrazola, N. Quesada, A. Delgado, Quantum Algorithm for Simulating Molecular Vibrational Excitations, <i>Phys. Chem. Chem. Phys.</i> 22, 25528, 2020.
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19) T.R. Bromley, J.M. Arrazola, S. Jahangiri, J. Izaac, N. Quesada, A. Delgado, Applications of Near-term Photonic Quantum Computers: Software and Algorithms, <i>Quantum Sci. Technol.</i> 5, 034010, 2020.
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18) S. Jahangiri, J.M. Arrazola, N. Quesada, N. Killoran, Point Processes with Gaussian Boson Sampling, <i>Phys. Rev. E</i>, 101, 022134, 2020.
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17) S. Tahmasebi, S. Jahangiri, N.J. Mosey, G, Jerkiewicz, S. Baranton, C. Coutanceau, Y. Furuya, A. Ohma, Oxidation and Corrosion of Platinum-Nickel and Platinum-Cobalt Nanoparticles in an Aqueous Acidic Medium, <i>ACS Appl. Energy Mater.</i> 2, 7019, 2019.
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16) M.S. Mahboub, S. Jahangiri, and H. Farrokhpour, Molecular Dynamics Simulation of the Hydration of Adenosine Phosphates, <i>J. Mol. Liq.</i> 283, 359, 2019.
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15) V. Bergholm, J. Izaac, M. Schuld, C. Gogolin, M.S. Alam, S. Ahmed, J.M. Arrazola, C. Blank, A. Delgado, S. Jahangiri, K. McKiernan, J.J. Meyer, Z. Niu, A. Szava, N. Killoran, PennyLane: Automatic Differentiation of Hybrid Quantum-classical Computations, arXiv:1811.04968, 2018.
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14) S. Jahangiri, N.J. Mosey, Computational Investigation of the Mechanism of Oxygen Evolution Reaction Catalysed by Nickel (Oxy)hydroxide, <i>J. Phys. Chem. C</i>, 122, 25785, 2018.
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<br>13) S. Jahangiri, Q.K. Timerghazin, H. Jiang, A.M. English, G.H. Peslherbe, Dramatic C--C Bond Activation on Protonation of the Persistent Nitroxyl Radical TEMPO, <i>Int. J. Mass. Spectrom.</i> 429, 182, 2018.
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12) S. Jahangiri, N.J. Mosey, Molecular Structure and Interactions of Water Intercalated in Nickel Hydroxides, <i>Phys. Chem. Chem. Phys.</i> 20, 11444, 2018.
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11) S. Jahangiri, N.J. Mosey, Density-Functional Tight-Binding Investigation of the Structure, Stability and Material Properties of Nickel hydroxide Nanotubes, <i>Nanotechnology</i>, 29, 025708, 2017.
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10) S. Jahangiri, N.J. Mosey, Effects of Reduced Dimensionality on the Properties of Magnesium Hydroxide and Calcium Hydroxide Nanostructures, <i>Phys. Chem. Chem. Phys.</i> 19, 1963, 2017.
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9) S. Jahangiri, G.S. Heverly-Coulson, N.J. Mosey, Development and Assessment of Atomistic Models for Predicting Static Friction Coefficient, <i>Phys. Rev. B</i>, 94, 075406, 2016.
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8) S. Jahangiri, H. Behnejad, An Analytical Equation of State for Ammonia at High Temperatures and High Pressures, <i>J. Mol. Liq.</i> 222, 733, 2016.
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7) S. Jahangiri, V. Legris-Falardeau, G.H. Peslherbe, Computational Investigation of the Hydration of Alkyl Diammonium Cations in Water Clusters, <i>Chem. Phys. Lett.</i> 621, 85, 2015.
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6) S. Jahangiri, L. Cai, G.H. Peslherbe, Performance of Density-Functional Tight-Binding Models in Describing Hydrogen-Bonded Anionic-Water Clusters, <i>J. Comput. Chem.</i> 35, 1707, 2014.
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5) M.M. Alavianmehr, H. Behnejad, S. Jahangiri, S.M. Hosseini, Thermodynamic Properties of Refrigerants from SM Sound Velocity-based Equation of State, <i>Phys. Chem. Liq.</i> 52, 546, 2014.
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4) S. Jahangiri, G. Dolgonos, T. Frauenheim, G.H. Peslherbe, Parameterization of Halogens for the Density-Functional Tight-Binding Description of Halide Hydration, <i>J. Chem. Theory Comput.</i> 9, 3321, 2013.
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3) S. Jahangiri, S.M. Mercer, P.G. Jessop, G.H. Peslherbe, Computational Investigation of the Hydration of Alkyl Diammonium Chlorides and Their Effect on Tetrahydrofuran/Water
Phase Separation, <i>J. Phys. Chem. B</i>, 117, 8010, 2013.
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2) S.M. Mercer, T. Robert, D.V. Dixon, C. Chen, Z. Ghoshouni, J.R. Harjani, S. Jahangiri, G.H. Peslherbe, P.G. Jessop, Design, Synthesis, and Solution Behaviour of Small Polyamines as Switchable Water Additives, <i>Green Chem.</i> 14, 832, 2012.
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<br>1) S. Jahangiri, M. Taghikhani, H. Behnejad, S.J. Ahmadi, Theoretical Investigation of Imidazolium Based Ionic Liquid/Alcohol Mixture: A Molecular Dynamic Simulation, <i>Mol. Phys.</i> 106, 1015, 2008.
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<hr width="600px" size="2">
<p style="margin: auto; width: 600px; color: dimgray; font-size: 14px"> <i> soranjh.github.io </i><p>