English
Related papers

Related papers: Calculating nonadiabatic couplings and Berry's pha…

200 papers

The variational quantum eigensolver (VQE), a variational algorithm to obtain an approximated ground state of a given Hamiltonian, is an appealing application of near-term quantum computers. The original work [A. Peruzzo et al.; \textit{Nat.…

Quantum Physics · Physics 2019-11-06 Ken M Nakanishi , Kosuke Mitarai , Keisuke Fujii

The adiabatic theorem is one of the most interesting and significant theorems in quantum mechanics. However, the adiabatic theorem can fail for general non-Hermitian quantum systems. In this paper, by utilizing the complex geometric phase,…

Quantum Physics · Physics 2026-03-05 Minyi Huang , Ray-Kuang Lee

We investigate the quantum mechanics of a single particle constrained to move along an arbitrary smooth reference curve by a confinement that is allowed to vary along the waveguide. The Schr\"odinger equation is evaluated in the adapted…

Quantum Physics · Physics 2014-03-26 J. Stockhofe , P. Schmelcher

Variational quantum eigensolver (VQE) is a hybrid quantum-classical technique that leverages noisy intermediate scale quantum (NISQ) hardware to obtain the minimum eigenvalue of a model Hamiltonian. VQE has so far been used to simulate…

Quantum Physics · Physics 2022-08-18 Marwa H. Farag , Joydip Ghosh

The accurate prediction and understanding of molecular energy and chemical reactivity are fundamental pursuits in the field of molecular quantum chemistry. With the limitations of the current noisy intermediate scale quantum computer (NISQ)…

Chemical Physics · Physics 2023-04-04 Abdul Kalam , Ashok Kumar , Prasanta K. Panigrahi

Quantum mechanical phases arising from a periodically varying Hamiltonian are considered. These phases are derived from the eigenvalues of a stationary, ``dressed'' Hamiltonian that is able to treat internal atomic or molecular structure in…

Atomic and Molecular Clusters · Physics 2015-05-14 Edmund R. Meyer , Aaron Leanhardt , Eric Cornell , John L. Bohn

The variational quantum eigensolver (VQE) is a hybrid quantum-classical variational algorithm that produces an upper-bound estimate of the ground-state energy of a Hamiltonian. As quantum computers become more powerful and go beyond the…

Variational quantum eigensolver (VQE) is a hybrid quantum-classical algorithm designed for noisy intermediate-scale quantum (NISQ) computers. It is promising for quantum chemical calculations (QCC) because it can calculate the ground-state…

Calculating excited states in chemistry is crucial to provide insight into photoinduced molecular behavior beyond the ground state, enabling innovations in spectroscopy, material sciences, and drug design. While several approaches have been…

Quantum Physics · Physics 2025-10-14 Akilan Rajamani , Martin Beseda , Benjamin Lasorne , Bruno Senjean

We develop a rigorous and highly accurate technique for calculation of the Berry phase in systems with a quadratic Hamiltonian within the context of the Kitaev honeycomb lattice model. The method is based on the recently found solution of…

Mesoscale and Nanoscale Physics · Physics 2015-03-19 Ahmet Tuna Bolukbasi , Jiri Vala

Many trial wavefunctions for fractional quantum Hall states in a single Landau level are given by functions called conformal blocks, taken from some conformal field theory. Also, wavefunctions for certain paired states of fermions in two…

Mesoscale and Nanoscale Physics · Physics 2011-09-08 N. Read

Variational Quantum Eigensolver (VQE) is a promising algorithm for near-term quantum machines. It can be used to estimate the ground state energy of a molecule by performing separate measurements of $O(N^4)$ terms. Several recent papers…

Quantum Physics · Physics 2019-09-02 Pranav Gokhale , Frederic T. Chong

This article is a brief introduction to quantum algorithms for the eigenvalue problem in quantum many-body systems. Rather than a broad survey of topics, we focus on providing a conceptual understanding of several quantum algorithms that…

Quantum Physics · Physics 2024-06-10 Dean Lee

The optimization of circuit parameters of variational quantum algorithms such as the variational quantum eigensolver (VQE) or the quantum approximate optimization algorithm (QAOA) is a key challenge for the practical deployment of near-term…

Quantum Physics · Physics 2019-04-09 Robert M. Parrish , Joseph T. Iosue , Asier Ozaeta , Peter L. McMahon

Variational quantum eigensolver (VQE) is regarded as a promising candidate of hybrid quantum-classical algorithm for the near-term quantum computers. Meanwhile, VQE is confronted with a challenge that statistical error associated with the…

Quantum Physics · Physics 2023-12-12 Ken N. Okada , Keita Osaki , Kosuke Mitarai , Keisuke Fujii

We theoretically study nonadiabatic corrections for charge pumping in a noninteracting electron model of a single-level quantum dot. We derive a formula for the velocity limit of parameter driving to realize adiabatic pumping and illustrate…

Mesoscale and Nanoscale Physics · Physics 2022-06-15 Masahiro Hasegawa , Takeo Kato

We develop a quantum-classical hybrid algorithm to calculate the analytical second-order derivative of the energy for the orbital-optimized variational quantum eigensolver (OO-VQE), which is a method to calculate eigenenergies of a given…

Chemical Physics · Physics 2023-04-19 Yuya O. Nakagawa , Jiabao Chen , Shotaro Sudo , Yu-ya Ohnishi , Wataru Mizukami

Adiabatic elimination is a perturbative model reduction technique based on timescale separation and often used to simplify the description of composite quantum systems. We here analyze a quantum experiment where the perturbative expansion…

Quantum Physics · Physics 2020-01-09 Alain Sarlette , Pierre Rouchon , Antoine Essig , Quentin Ficheux , Benjamin Huard

Quantum chemistry and condensed matter physics are among the most promising applications of quantum computers. Further, estimating properties of a material is crucial to evaluate its industrial applications. To investigate charge…

Quantum Physics · Physics 2026-02-19 Erik Schultheis , Alexander Rehn , Gabriel Breuil

We present a detailed study of an adiabatic state preparation in an effective three-level quantum system. States can be prepared with high speed and fidelity by adding a counterdiabatic (CD) quantum control protocol. As a second step, we…

Quantum Physics · Physics 2026-01-13 L. Romanato , N. Eshaqi-Sani , L. Lepori , T. Kirova , E. Arimondo , S. Wimberger