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We describe how to efficiently construct the quantum chemical Hamiltonian operator in matrix product form. We present its implementation as a density matrix renormalization group (DMRG) algorithm for quantum chemical applications in a…

Computational Physics · Physics 2016-01-05 Sebastian Keller , Michele Dolfi , Matthias Troyer , Markus Reiher

As an extension of Gabor signal processing, the covariant Weyl-Heisenberg integral quantization is implemented to transform functions on the eight-dimensional phase space $\left(x,k\right)$ into Hilbertian operators. The…

Quantum Physics · Physics 2022-06-22 Gilles Cohen-Tannoudji , Jean-Pierre Gazeau , Célestin Habonimana , Juma Shabani

We present a general method for simulating lattice gauge theories in low dimensions using infinite matrix product states (iMPS). A central challenge in Hamiltonian formulations of gauge theories is the unbounded local Hilbert space…

Strongly Correlated Electrons · Physics 2025-08-21 Nicholas Godfrey , Ian P. McCulloch

Matrix product states (MPSs) and matrix product operators (MPOs) allow an alternative formulation of the density matrix renormalization group algorithm introduced by White. Here, we describe how non-abelian spin symmetry can be exploited in…

Chemical Physics · Physics 2016-04-05 Sebastian Keller , Markus Reiher

A precise definition of an adiabaticity parameter $\nu$ of a time-dependent Hamiltonian is proposed. A variation of the time-dependent perturbation theory is presented which yields a series expansion of the evolution operator…

High Energy Physics - Theory · Physics 2009-10-30 Ali Mostafazadeh

The real homogeneous Monge-Amp\`{e}re equation in one space and one time dimensions admits infinitely many Hamiltonian operators and is completely integrable by Magri's theorem. This remarkable property holds in arbitrary number of…

solv-int · Physics 2009-10-31 Y. Nutku

We propose a generalization of Heisenberg picture quantum mechanics in which a Lagrangian and Hamiltonian dynamics is formulated directly for dynamical systems on a manifold with non--commuting coordinates, which act as operators on an…

High Energy Physics - Theory · Physics 2010-11-01 Stephen L. Adler

A model operator approach to calculations of the QED corrections to energy levels in relativistic many-electron atomic systems is developed. The model Lamb shift operator is represented by a sum of local and nonlocal potentials which are…

Atomic Physics · Physics 2013-07-26 V. M. Shabaev , I. I. Tupitsyn , V. A. Yerokhin

By taking the Weyl equation with external electro-magnetic potentials as the simplest representative for a system of PDOs, we give a new method of treating non-commutativity of coefficients matrices. More precisely, we construct a Fourier…

Mathematical Physics · Physics 2007-05-23 Atsushi Inoue

We develop a systematic and general approach to study the effective Higgs Lagrangian in a supersymmetric framework in which the Higgs fields in the visible sector couple weakly to another sector. The extra sector may be strongly coupled in…

High Energy Physics - Phenomenology · Physics 2017-09-18 Piyush Kumar , Daliang Li , David Poland , Andreas Stergiou

We introduce a matrix product operator (MPO) encoding of the Magnus expansion and the Dyson series for one-dimensional quantum lattice models with time-dependent Hamiltonians. The MPO construction can be made accurate up to arbitrary order…

We present an automated framework for constructing Taylor series expansions of rovibrational kinetic and potential energy operators for arbitrary molecules, internal coordinate systems, and molecular frame embedding conditions. Expressing…

Atomic and Molecular Clusters · Physics 2025-07-29 Andrey Yachmenev , Emil Vogt , Álvaro Fernández Corral , Yahya Saleh

In this paper the evolution of a quantum system drived by a non-Hermitian Hamiltonian depending on slowly-changing parameters is studied by building an universal high-order adiabatic approximation(HOAA) method with Berry's phase ,which is…

High Energy Physics - Theory · Physics 2009-10-22 Chang-Pu Sun

A global solution of the Schr\"odinger equation, obtained recently within the wave operator formalism for explicitly time-dependent Hamiltonians [J. Phys. A: Math. Theor. 48, 225205 (2015)], is generalized to take into account the case of…

Quantum Physics · Physics 2016-04-20 Georges Jolicard , Arnaud Leclerc , David Viennot , John P. Killingbeck

We present a systematic perturbative construction of the most general metric operator (and positive-definite inner product) for quasi-Hermitian Hamiltonians of the standard form, H= p^2/2 + v(x), in one dimension. We show that this problem…

Quantum Physics · Physics 2009-11-11 Ali Mostafazadeh

The evolution of a quantum system is governed by the associated Hamiltonian. A system defined by a parameter-dependent Hamiltonian acquires a geometric phase when adiabatically evolved. Such an adiabatic evolution of a system having…

The time-evolution operator for an explicitly time-dependent Hamiltonian is expressed as the product of a sequence of unitary operators. These are obtained by successive time-dependent unitary transformations of the Hilbert space followed…

Quantum Physics · Physics 2009-10-30 Ali Mostafazadeh

In this paper we consider energy operator (a free Hamiltonian), in the second-quantized approach, for the multiparameter quon algebras: $a_{i}a_{j}^{\dagger}-q_{ij}a_{j}^{\dagger}a_{i} = \delta_{ij}, i,j\in I$ with $(q_{ij})_{i,j\in I}$ any…

Mathematical Physics · Physics 2009-11-10 Stjepan Meljanac , Ante Perica , Dragutin Svrtan

Prior to the recent development of symplectic integrators, the time-stepping operator $\e^{h(A+B)}$ was routinely decomposed into a sum of products of $\e^{h A}$ and $\e^{hB}$ in the study of hyperbolic partial differential equations. In…

Numerical Analysis · Mathematics 2010-05-14 Siu A. Chin , Jurgen Geiser

We present an effective operator formalism for open quantum systems. Employing perturbation theory and adiabatic elimination of excited states for a weakly driven system, we derive an effective master equation which reduces the evolution to…

Quantum Physics · Physics 2012-07-03 Florentin Reiter , Anders S. Sørensen
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