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In this work, we extend the Piris natural orbital functionals (PNOFs) to excited states by coupling their reconstructed second-order reduced density matrices with the extended random-phase approximation (ERPA). We have named the general…

We present a mean-photon-number dependent variational method, which works well in whole coupling regime if the photon energy is dominant over the spin-flipping, to evaluate the properties of the Rabi model for both the ground state and the…

Quantum Physics · Physics 2017-02-24 Maoxin Liu , Zu-Jian Ying , Jun-Hong An , Hong-Gang Luo

We analyze the many-particle Schrodinger equation for fermions in a thermal ensemble by introducing an exponential operator expansion, defined in the context of thermofield dynamics. The expansion is optimized variationally at each time…

Statistical Mechanics · Physics 2020-01-10 Edward B. Baker

Ensuring a satisfactory statistical convergence of anharmonic thermodynamic properties requires sampling of many atomic configurations, however the methods to obtain those necessarily produce correlated samples, thereby reducing the…

Statistical Mechanics · Physics 2022-06-07 Erki Metsanurk

We test an optimised hopping parameter expansion on various Z_2 lattice scalar field models: the Ising model, a spin-one model and lambda (phi)^4. We do this by studying the critical indices for a variety of optimisation criteria, in a…

High Energy Physics - Phenomenology · Physics 2007-05-23 T. S. Evans , M. Ivin

While Hartree-Fock theory is well established as a fundamental approximation for interacting fermions, it has been unclear how to describe corrections to it due to many-body correlations. In this paper we start from the Hartree-Fock state…

Mathematical Physics · Physics 2020-04-13 Niels Benedikter , Phan Thành Nam , Marcello Porta , Benjamin Schlein , Robert Seiringer

Squeezed states of harmonic oscillators are a central resource for continuous-variable quantum sensing, computation and communication. Here we propose a method for the generation of very good approximations to highly squeezed vacuum states…

Quantum Physics · Physics 2021-04-21 Jacob Hastrup , Kimin Park , Radim Filip , Ulrik L. Andersen

The Hamiltonian of the Rabi model is considered. It is shown that the ground state energy of the Rabi Hamiltonian is simple for all values of the coupling strength, which implies the ground state energy does not cross other energy

Mathematical Physics · Physics 2012-07-18 Masao Hirokawa , Fumio Hiroshima

The expectation value of the Hamiltonian using a model wave function is widely used to estimate the eigenvalues of electronic Hamiltonians. We explore here a modified formula for models based on long-range interaction. It scales differently…

Chemical Physics · Physics 2024-06-13 Anthony Scemama , Andreas Savin

Here we propose a new approach for performing a Taylor series expansion of the first-principles computed energy of a crystal as a function of the nuclear displacements. We enlarge the dimensionality of the existing displacement space and…

Materials Science · Physics 2014-08-06 Xinyuan Ai , Yue Chen , Chris A. Marianetti

A direct orbital optimization method is presented for density functional calculations of excited electronic states using either a real space grid or a plane wave basis set. The method is variational, provides atomic forces in the excited…

Computational Physics · Physics 2022-11-09 Aleksei V. Ivanov , Gianluca Levi , Elvar Ö. Jónsson , Hannes Jónsson

Using extended coherent states, an analytically exact study has been carried out for the quantum Rabi model with two equivalent qubits. Compact transcendental functions of one variable have been derived leading to exact solutions. The…

Quantum Physics · Physics 2015-06-18 Hui Wang , Shu He , Liwei Duan , Yang Zhao , Qing-Hu Chen

The ground states and excited states of the Lipkin model hamiltonian are calculated using a new theoretical approach which has been derived from an extended time-dependent Hartree-Fock theory known as the time-dependent density-matrix…

Nuclear Theory · Physics 2009-11-10 S. Takahara , M. Tohyama , P. Schuck

By means of Trotter's formula, we show that transition amplitudes between a class of generalized coherent states in the Rabi model can be understood in terms of a certain Ising model featuring long-range interactions beyond nearest…

Quantum Physics · Physics 2025-12-18 Bruno Scheihing-Hitschfeld , Néstor Sepúlveda

Extracting molecular properties from a wave function can be done through the linear response (LR) formalism or, equivalently, the equation of motion (EOM) formalism. For a simple model system, He in a 6-31G basis, it is here shown that…

We study the excited states of the pairing Hamiltonian providing an expansion for their energy in the strong coupling limit. To assess the role of the pairing interaction we apply the formalism to the case of a heavy atomic nucleus. We show…

Nuclear Theory · Physics 2015-06-16 M. B. Barbaro , R. Cenni , A. Molinari , M. R. Quaglia

Richardson equations can be mapped on the classical electrostatic problem in two dimensions. We have recently suggested a new analytical approach to these equations in the thermodynamical limit, which is based on the `probability' of the…

Superconductivity · Physics 2012-08-08 W. V. Pogosov

Starting from the Rabi Hamiltonian, which is useful in arriving at non-perturbative results within the rotating wave approximation, we have found Einstein's $B$ coefficient to be time-dependent: $B(t)\propto|J_0(\omega_\gamma t)|$ for a…

Quantum Physics · Physics 2019-11-14 Najirul Islam , Tanmoy Mondal , Sagar Chakraborty , Shyamal Biswas

We develop a method that can constrain any local exchange-correlation potential to preserve ba-sic exact conditions. Using the method of Lagrange multipliers, we calculate for each set of given Kohn-Sham orbitals, a constraint-preserving…

Strongly Correlated Electrons · Physics 2009-05-11 Yair Kurzweil Martin Head-Gordon

We present an approximation scheme for the calculation of the principal excitation energies and transition moments of finite many-body systems. The scheme is derived from a first order approximation to the self energy of a recently proposed…

Chemical Physics · Physics 2009-10-30 Joachim Brand , Lorenz S. Cederbaum
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