This profile is built from public research funding records (CIHR, NSERC and SSHRC) and PubMed. We have not imported them from a University of Toronto directory, so their courses may be missing. Find their university profile.
Latest papers
Bis(2-Adamantyl)Magnesium: Synthesis, Structure, and Applications of a Versatile and Shelf-Stable 2-Adamantyl Anion Equivalent.
Chemistry (Weinheim an der Bergstrasse, Germany) · 2026 · senior author
Parametrized Quantum Circuit Learning for Quantum Chemical Applications.
Journal of chemical information and modeling · 2026
Ligand Substitution in Ni(CO)4─Computational Discovery of a Long-Suspected "Dark Pathway" and a Detailed Analysis of the Intrinsic Reaction Coordinate.
Inorganic chemistry · 2026
Latest funding
- $25,000
Diamond-inspired molecular qubits
NSERC · 2023 · Principal investigator
- $2,000,000
Quantum software consortium: Exploring distributed Quantum solutions for Canada
NSERC · 2023 · Co-investigator
- $125,000
Quantum Machine Learning Advantage for Molecular Property Predictions
SSHRC · 2022 · Co-investigator
29 publications.
Bis(2-Adamantyl)Magnesium: Synthesis, Structure, and Applications of a Versatile and Shelf-Stable 2-Adamantyl Anion Equivalent.
DaCosta MV, Taullaj F, Lin JH, Fekl U
Parametrized Quantum Circuit Learning for Quantum Chemical Applications.
Jones GM, Prasad VK, Fekl U, Jacobsen HA
Ligand Substitution in Ni(CO)4─Computational Discovery of a Long-Suspected "Dark Pathway" and a Detailed Analysis of the Intrinsic Reaction Coordinate.
Ćoćić D, Puchta R, Kapp J, Fekl U, Jiao H, van Eldik R
Heteroatom-vacancy centres in molecular nanodiamonds: a computational study of organic molecules possessing triplet ground states through σ-overlap.
Macarios CM, Pittner J, Prasad VK, Fekl U
Organic Polar Crystals, Second Harmonic Generation, and Piezoelectric Effects from Heteroadamantanes in the Space Group R3m.
Abdur-Rashid K, Saha SK, Mugisha J, Teale S, Wang S, Saber M, Lough AJ, Sargent EH, Fekl U
Applications of noisy quantum computing and quantum error mitigation to "adamantaneland": a benchmarking study for quantum chemistry.
Prasad VK, Cheng F, Fekl U, Jacobsen HA
Why Diorganyl Zinc Lewis Acidity Dramatically Increases with Narrowing C-Zn-C Bond Angle.
Mirabi B, Poh WC, Armstrong D, Lough AJ, Fekl U
An iridium complex with an unsupported Ir-Zn bond: di-iodido-(η5-penta-methyl-cyclo-penta-dien-yl)bis-(tri-methyl-phosphane)iridiumzinc(Ir-Zn) benzene hemisolvate.
Taullaj F, Lough AJ, Fekl U
A molybdenum tris-(di-thiol-ene) complex coordinates to three bound cobalt centers in three different ways.
Nguyen N, Lough AJ, Fekl U
A new structural model for NiFe hydrogenases: an unsaturated analogue of a classic hydrogenase model leads to more enzyme-like Ni-Fe distance and inter-planar fold.
Harrison DJ, Lough AJ, Fekl U
Diamond-inspired molecular qubits
Principal investigators: Fekl, Ulrich UW
Keywords: diamond; diamondoid; nv centre; persistent radical; quantum computing; qubit
Quantum software consortium: Exploring distributed Quantum solutions for Canada
Principal investigators: Jacobsen, Hans-Arno H-A
Keywords: catalyst search, reaction design; compilation for dqc; distributed quantum computing (dqc); error correction, error mitigation; fault-tolerant quantum computing; hybrid quantum-classical computing; noisy intermediate-scale quantum com; quantum chemestry, drug design; quantum computing and algorithms; quantum materials
Quantum Machine Learning Advantage for Molecular Property Predictions
Principal investigators: Jacobsen, Hans-Arno
Keywords: Quantum computing; Quantum information processing; Machine learning; Quantum machine learning; Quantum chemistry; Computational chemistry; Catalysis; Materials science; Molecular property prediction
Transformations of adamantyls and other molecular nanodiamonds in the coordination sphere of metals
Principal investigators: Fekl, Ulrich
Keywords: metal alkyl; diamondoid; adamantane; transmetallation; transition metal; nanodiamond
Understanding and Exploiting Transition Metal Complexes with Redox-active Ligands
Principal investigators: Fekl, Ulrich
Low Temperature EPR Spectrometer
Principal investigators: Stephan, Douglas
Replacement of the departmental X-ray diffractometer
Principal investigators: Morris, Robert
Transition Metal Complexes with Redox-active Ligands: Understanding and Using Unusual Electronic Structures and Ligand-based reactivity
Principal investigators: Fekl, Ulrich
Electrophilic metal complexes: new topologies, new modes of substrate binding
Principal investigators: Fekl, Ulrich
400 MHz NMR spectrometer for `walk-on` use in chemical synthesis at UTM
Principal investigators: Fekl, Ulrich
From CIHR, NSERC and SSHRC funding decisions: CIHR since 2008, NSERC since 1991 and SSHRC since 1998, including their latest published competition results.
Frequent collaborators
- Virginijus Barzda and Bryan Stewart: 5 shared papers
- Virginijus Barzda and Ulrich Fekl: 5 shared papers
- Hans-Arno Jacobsen and Ulrich Fekl: 2 shared papers
- Bryan Stewart and Ulrich Fekl: 1 shared paper
- Chemistry
- Department of Chemical and Physical Sciences
- Electrical & Computer Engineering
- Department of Biology
Co-authors at University of Toronto, colored by department. Thicker lines mean more shared papers; select anyone to open their profile and their own map.
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