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D-Index & Metrics

Chemistry

D-Index
73
Citations
20928
World Ranking
4915
National Ranking
1540

Overview

Ivano Tavernelli is a researcher affiliated with IBM in the United States. Their work spans multiple areas within computer science and physics, with a focus on quantum computing and related fields.

The scientist's primary fields of study include:

  • Computer Science
  • Physics and Astronomy

Within these areas, they have contributed to several subfields, notably:

  • Artificial Intelligence
  • Atomic and Molecular Physics, and Optics
  • Computational Theory and Mathematics
  • Nuclear and High Energy Physics
  • Materials Chemistry

Key topics of Tavernelli's research involve quantum computing and physical phenomena associated with quantum systems. These main topics are:

  • Quantum Computing Algorithms and Architecture
  • Quantum Information and Cryptography
  • Quantum and electron transport phenomena
  • Quantum many-body systems
  • Neural Networks and Reservoir Computing
  • Computational Physics and Python Applications
  • Spectroscopy and Quantum Chemical Studies

Tavernelli has collaborated extensively with various researchers. Some frequent coauthors include:

  • Francesco Tacchino
  • Panagiotis Kl. Barkoutsos
  • Alessandro Chiesa
  • Stefano Carretta
  • Pauline J. Ollitrault

They have published across several notable venues, with repeated contributions in:

  • arXiv (Cornell University)
  • Zenodo (CERN European Organization for Nuclear Research)
  • Physical Review Research
  • PRX Quantum
  • Journal of Chemical Theory and Computation

Recent papers from Tavernelli include:

  • Quantum equation of motion for computing molecular excitation energies on a noisy quantum processor, 2020, Repository for Publications and Research Data (ETH Zurich)
  • Quantum Computing for High-Energy Physics: State of the Art and Challenges, 2024, PRX Quantum
  • Charge Separation and Charge Carrier Mobility in Photocatalytic Metal-Organic Frameworks, 2020, Advanced Functional Materials
  • On-surface synthesis of a doubly anti-aromatic carbon allotrope, 2023, Nature
  • Learning to Measure: Adaptive Informationally Complete Generalized Measurements for Quantum Algorithms, 2021, PRX Quantum

Best Publications

  • Dye-sensitized solar cells with 13% efficiency achieved through the molecular engineering of porphyrin sensitizers

    Simon Mathew;Aswani Yella;Peng Gao;Robin Humphry-Baker

  • Qiskit: An Open-source Framework for Quantum Computing

    Gadi Aleksandrowicz;Thomas Alexander;Panagiotis Barkoutsos;Luciano Bello

  • Optimization of Effective Atom Centered Potentials for London Dispersion Forces in Density Functional Theory

    O. Anatole von Lilienfeld;Ivano Tavernelli;Ursula Rothlisberger;Daniel Sebastiani

  • New Paradigm in Molecular Engineering of Sensitizers for Solar Cell Applications

    Takeru Bessho;Eiji Yoneda;Jun-Ho Yum;Matteo Guglielmi

  • Trajectory Surface Hopping within Linear Response Time-Dependent Density-Functional Theory

    Enrico Tapavicza;Ivano Tavernelli;Ursula Rothlisberger

  • Structure and Dynamics of Liquid Water from ab Initio Molecular Dynamics-Comparison of BLYP, PBE, and revPBE Density Functionals with and without van der Waals Corrections.

    I-Chun Lin;Ari P Seitsonen;Ivano Tavernelli;Ursula Rothlisberger

  • Quantum equation of motion for computing molecular excitation energies on a noisy quantum processor

    Pauline J. Ollitrault;Pauline J. Ollitrault;Abhinav Kandala;Chun-Fu Chen;Panagiotis Kl. Barkoutsos

  • Quantum orbital-optimized unitary coupled cluster methods in the strongly correlated regime: Can quantum algorithms outperform their classical equivalents?

    Igor O Sokolov;Panagiotis Kl Barkoutsos;Pauline J Ollitrault;Donny Greenberg

  • Mixed time-dependent density-functional theory/classical trajectory surface hopping study of oxirane photochemistry

    Enrico Tapavicza;Ivano Tavernelli;Ursula Rothlisberger;Claudia Filippi

  • Binding of Organometallic Ruthenium(II) and Osmium(II) Complexes to an Oligonucleotide: A Combined Mass Spectrometric and Theoretical Study

    Antoine Dorcier;Paul J. Dyson;Christian Gossens;Ursula Rothlisberger

  • Electronic structure and solvation of copper and silver ions: a theoretical picture of a model aqueous redox reaction

    Jochen Blumberger;Leonardo Bernasconi;Ivano Tavernelli;Rodolphe Vuilleumier

  • Importance of van der Waals interactions in liquid water.

    I-Chun Lin;Ari P. Seitsonen;Maurício D. Coutinho-Neto;Ivano Tavernelli

  • Trajectory‐Based Nonadiabatic Dynamics with Time‐Dependent Density Functional Theory

    Basile F. E. Curchod;Ursula Rothlisberger;Ivano Tavernelli

  • Library of dispersion-corrected atom-centered potentials for generalized gradient approximation functionals: Elements H, C, N, O, He, Ne, Ar, and Kr

    I-Chun Lin;Maurício D. Coutinho-Neto;Camille Felsenheimer;O. Anatole von Lilienfeld

  • Acid-Induced Degradation of Phosphorescent Dopants for OLEDs and Its Application to the Synthesis of Tris-heteroleptic Iridium(III) Bis-cyclometalated Complexes

    Etienne Baranoff;Basile F E Curchod;Julien Frey;Rosario Scopelliti

  • Influence of Hydrogen-Bonding Substituents on the Cytotoxicity of RAPTA Compounds

    Claudine Scolaro;Tilmann J. Geldbach;Sébastien Rochat;Antoine Dorcier

  • Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa

    Michele Cascella;Alessandra Magistrato;Ivano Tavernelli;Paolo Carloni

  • Molecular dynamics in electronically excited states using time-dependent density functional theory

    Ivano Tavernelli;Ute F. Röhrig;Ursula Rothlisberger

  • Diabatic free energy curves and coordination fluctuations for the aqueous Ag+∕Ag2+ redox couple: A biased Born-Oppenheimer molecular dynamics investigation

    Jochen Blumberger;Ivano Tavernelli;Michael L. Klein;Michiel Sprik

  • Variational optimization of effective atom centered potentials for molecular properties.

    O. Anatole von Lilienfeld;Ivano Tavernelli;Ursula Rothlisberger;Daniel Sebastiani

  • Molecular Engineering of a Fluorene Donor for Dye-Sensitized Solar Cells

    Aswani Yella;Robin Humphry-Baker;Basile F. E. Curchod;Negar Ashari Astani

Frequent Co-Authors

Ursula Rothlisberger
Ursula Rothlisberger École Polytechnique Fédérale de Lausanne
Thomas J. Penfold
Thomas J. Penfold Newcastle University
Majed Chergui
Majed Chergui École Polytechnique Fédérale de Lausanne
Rodolphe Vuilleumier
Rodolphe Vuilleumier École Normale Supérieure
Alexandre Blais
Alexandre Blais Canadian Institute for Advanced Research
Michael Grätzel
Michael Grätzel École Polytechnique Fédérale de Lausanne
Angel Rubio
Angel Rubio Max Planck Institute for the Structure and Dynamics of Matter
Marie-Pierre Gaigeot
Marie-Pierre Gaigeot University of Évry Val d'Essonne
Etienne Baranoff
Etienne Baranoff University of Birmingham
Jay M. Gambetta
Jay M. Gambetta IBM (United States)

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