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Quantum simulation of molecules without fermionic encoding of the wave function

New journal of physics, 2021-11, Vol.23 (11), p.113037

2021

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Quantum Solver of Contracted Eigenvalue Equations for Scalable Molecular Simulations on Quantum Computing Devices

Physical review letters, 2021-02, Vol.126 (7), p.070504-070504, Article 070504

2021

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Relaxation of stationary states on a quantum computer yields a unique spectroscopic fingerprint of the computer’s noise

Communications physics, 2022-01, Vol.5 (1), p.1-7, Article 28

2022

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Accelerated Convergence of Contracted Quantum Eigensolvers through a Quasi-Second-Order, Locally Parameterized Optimization

Journal of chemical theory and computation, 2022-09, Vol.18 (9), p.5286-5296

2022

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Cavity-Mediated Molecular Entanglement and Generation of Non-classical States of Light

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-02, Vol.128 (4), p.799-806

2024

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Many-Body Excited States with a Contracted Quantum Eigensolver

Journal of chemical theory and computation, 2024-05, Vol.20 (9), p.3580-3589

2024

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Author Correction: Relaxation of stationary states on a quantum computer yields a unique spectroscopic fingerprint of the computer’s noise

Communications physics, 2022-02, Vol.5 (1), p.1-1, Article 41

2022

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Stabilization of cationic aluminum hydroxide clusters in high pH environments with a CaCl2/l-arginine matrix

Chemical communications (Cambridge, England), 2019-05, Vol.55 (43), p.5998-6001

2019

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Stabilization of cationic aluminum hydroxide clusters in high pH environments with a CaCl 2 /l-arginine matrix

Chemical communications (Cambridge, England), 2019-05, Vol.55 (43), p.5998-6001

2019

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Quantum-classical hybrid algorithm for the simulation of all-electron correlation

The Journal of chemical physics, 2021-12, Vol.155 (24), p.244106-244106

2021

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Isomerization of Keggin Al13 Ions Followed by Diffusion Rates

Chemistry : a European journal, 2016-12, Vol.22 (52), p.18682-18685

2016

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Qubit Condensation for Assessing Efficacy of Molecular Simulation on Quantum Computers

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-07, Vol.127 (29), p.6032-6039

2023

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Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2ONO radical and support a non-IRC pathway

The Journal of chemical physics, 2018-07, Vol.149 (2), p.024302-024302

2018

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Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH 2 CH 2 ONO radical and support a non-IRC pathway

The Journal of chemical physics, 2018-07, Vol.149 (2), p.024302

2018

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Isomerization of Keggin Al13 Ions Followed by Diffusion Rates

Chemistry : a European journal, 2016-12, Vol.22 (52), p.18637-18637

2016

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Cover Picture: Isomerization of Keggin Al13 Ions Followed by Diffusion Rates (Chem. Eur. J. 52/2016)

Chemistry : a European journal, 2016-12, Vol.22 (52), p.18633-18633

2016

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Ultrathin Hybrid Films of Polyoxohydroxy Clusters and Proteins: Layer-by-Layer Assembly and Their Optical and Mechanical Properties

Langmuir, 2014-05, Vol.30 (18), p.5248-5255

2014

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Quantum-classical hybrid algorithm using an error-mitigating N -representability condition to compute the Mott metal-insulator transition

Physical review. A, 2019-08, Vol.100 (2), Article 022517

2019

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Many-fermion simulation from the contracted quantum eigensolver without fermionic encoding of the wave function

Physical review. A, 2022-06, Vol.105 (6), Article 062424

2022

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Verifiably exact solution of the electronic Schrödinger equation on quantum devices

Physical review. A, 2024-02, Vol.109 (2), Article 022802

2024

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Lowering tomography costs in quantum simulation with a symmetry projected operator basis

Physical review. A, 2021-01, Vol.103 (1), Article 012420

2021

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Quantum-classical hybrid algorithm for the simulation of all-electron correlation

The Journal of chemical physics, 2021-12, Vol.155 (24)

2021

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Controlled step-wise isomerization of the Keggin-type Al13 and determination of the γ-Al13 structure

Chemical communications (Cambridge, England), 2013-11, Vol.49 (97), p.11352

2013

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Resolving correlated states of benzyne with an error-mitigated contracted quantum eigensolver

Physical review. A, 2022-02, Vol.105 (2), Article 022405

2022

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Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2 ONO radical and support a non-IRC pathway

The Journal of chemical physics, 2018-07, Vol.149 (2)

2018

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Quantum simulation of molecules without fermionic encoding of the wave function

Quantum Solver of Contracted Eigenvalue Equations for Scalable Molecular Simulations on Quantum Computing Devices

Relaxation of stationary states on a quantum computer yields a unique spectroscopic fingerprint of the computer’s noise

Accelerated Convergence of Contracted Quantum Eigensolvers through a Quasi-Second-Order, Locally Parameterized Optimization

Cavity-Mediated Molecular Entanglement and Generation of Non-classical States of Light

Many-Body Excited States with a Contracted Quantum Eigensolver

Author Correction: Relaxation of stationary states on a quantum computer yields a unique spectroscopic fingerprint of the computer’s noise

Stabilization of cationic aluminum hydroxide clusters in high pH environments with a CaCl2/l-arginine matrix

Stabilization of cationic aluminum hydroxide clusters in high pH environments with a CaCl 2 /l-arginine matrix

Quantum-classical hybrid algorithm for the simulation of all-electron correlation

Isomerization of Keggin Al13 Ions Followed by Diffusion Rates

Qubit Condensation for Assessing Efficacy of Molecular Simulation on Quantum Computers

Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2ONO radical and support a non-IRC pathway

Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH 2 CH 2 ONO radical and support a non-IRC pathway

Isomerization of Keggin Al13 Ions Followed by Diffusion Rates

Cover Picture: Isomerization of Keggin Al13 Ions Followed by Diffusion Rates (Chem. Eur. J. 52/2016)

Ultrathin Hybrid Films of Polyoxohydroxy Clusters and Proteins: Layer-by-Layer Assembly and Their Optical and Mechanical Properties

Quantum-classical hybrid algorithm using an error-mitigating N -representability condition to compute the Mott metal-insulator transition

Many-fermion simulation from the contracted quantum eigensolver without fermionic encoding of the wave function

Verifiably exact solution of the electronic Schrödinger equation on quantum devices

Lowering tomography costs in quantum simulation with a symmetry projected operator basis

Quantum-classical hybrid algorithm for the simulation of all-electron correlation

Controlled step-wise isomerization of the Keggin-type Al13 and determination of the γ-Al13 structure

Resolving correlated states of benzyne with an error-mitigated contracted quantum eigensolver

Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2 ONO radical and support a non-IRC pathway

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