activity
20152019
most citedQuantum Chemistry in the Age of Quantum Computing

1.5k citations · 3.3k across the 10 of their papers we have counts for

collaborators

11 papers

quant-ph2019★ 5 cited

Phase estimation with randomized Hamiltonians

Ian D. Kivlichan, Christopher E. Granade, Nathan Wiebe

Iterative phase estimation has long been used in quantum computing to estimate Hamiltonian eigenvalues. This is done by applying many repetitions of the same fundamental simulation…

quant-ph2019★ 167 cited

Improved Fault-Tolerant Quantum Simulation of Condensed-Phase Correlated Electrons via Trotterization

Ian D. Kivlichan, Craig Gidney, Dominic W. Berry +9

Recent work has deployed linear combinations of unitaries techniques to reduce the cost of fault-tolerant quantum simulations of correlated electron models. Here, we show that one…

quant-ph2018★ 1.5k cited

Quantum Chemistry in the Age of Quantum Computing

Yudong Cao, Jonathan Romero, Jonathan P. Olson +10

Practical challenges in simulating quantum systems on classical computers have been widely recognized in the quantum physics and quantum chemistry communities over the past century…

quant-ph2017★ 431 cited

Quantum Simulation of Electronic Structure with Linear Depth and Connectivity

Ian D. Kivlichan, Jarrod McClean, Nathan Wiebe +4

As physical implementations of quantum architectures emerge, it is increasingly important to consider the cost of algorithms for practical connectivities between qubits. We show th…

quant-ph2017

OpenFermion: The Electronic Structure Package for Quantum Computers

Jarrod R. McClean, Kevin J. Sung, Ian D. Kivlichan +32

Quantum simulation of chemistry and materials is predicted to be an important application for both near-term and fault-tolerant quantum devices. However, at present, developing and…

quant-ph2017★ 50 cited

qTorch: The Quantum Tensor Contraction Handler

E. Schuyler Fried, Nicolas P. D. Sawaya, Yudong Cao +3

Classical simulation of quantum computation is necessary for studying the numerical behavior of quantum algorithms, as there does not yet exist a large viable quantum computer on w…

quant-ph2017★ 18 cited

Quantum Information and Computation for Chemistry

Jonathan Olson, Yudong Cao, Jonathan Romero +7

The NSF Workshop in Quantum Information and Computation for Chemistry assembled experts from directly quantum-oriented fields such as algorithms, chemistry, machine learning, optic…

quant-ph2016★ 63 cited

Bounding the costs of quantum simulation of many-body physics in real space

Ian D. Kivlichan, Nathan Wiebe, Ryan Babbush +1

We present a quantum algorithm for simulating the dynamics of a first-quantized Hamiltonian in real space based on the truncated Taylor series algorithm. We avoid the possibility o…

quant-ph2015★ 806 cited

Scalable Quantum Simulation of Molecular Energies

P. J. J. O'Malley, R. Babbush, I. D. Kivlichan +27

We report the first electronic structure calculation performed on a quantum computer without exponentially costly precompilation. We use a programmable array of superconducting qub…

quant-ph2015★ 87 cited

Exponentially More Precise Quantum Simulation of Fermions in the Configuration Interaction Representation

Ryan Babbush, Dominic W. Berry, Yuval R. Sanders +5

We present a quantum algorithm for the simulation of molecular systems that is asymptotically more efficient than all previous algorithms in the literature in terms of the main pro…

quant-ph2015★ 138 cited

Exponentially more precise quantum simulation of fermions I: Quantum chemistry in second quantization

Ryan Babbush, Dominic W. Berry, Ian D. Kivlichan +3

We introduce novel algorithms for the quantum simulation of molecular systems which are asymptotically more efficient than those based on the Trotter-Suzuki decomposition. We prese…