We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the treatment of Coulomb-type interactions, and we apply it to study the quantum evolution of molecules in the Born-Oppenheimer approximation, in the case where the electronic Hamiltonian admits a local gap in its spectrum. In particular, we show that the molecular evolution can be reduced to the one of a system of smooth semiclassical operators, the symbol of which can be computed explicitely. In addition, we study the propagation of certain wave packets up to long time values of Ehrenfest order
We consider the eigenvalue problem for a one-dimensional molecular-type quantum Hamiltonian that has...
We present a rigorous derivation of classical molecular dynamics (MD) from quantum molecular dynami...
In this paper we analyze the evolution of the time averaged energy densities associatedwith a family...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We consider the Schrodinger operator P(h) for a polyatomic molecule in the semiclassical limit where...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
Motivated by the paper [SW] by B.T. Sutcliffe and R.G. Woolley, we present the main ideas used by ma...
Motivated by the paper [SW1] by B.T. Sutcliffe and R.G. Woolley, we present the main ideas used by m...
When considering the work of Carl Ballhausen on vibrational spectra, it is suggested that his use of...
International audienceIn this paper, we use the Born-Oppenheimer approximation to study the elastic ...
We consider the eigenvalue problem for a one-dimensional molecular-type quantum Hamiltonian that has...
We present a rigorous derivation of classical molecular dynamics (MD) from quantum molecular dynami...
In this paper we analyze the evolution of the time averaged energy densities associatedwith a family...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the tre...
We consider the Schrodinger operator P(h) for a polyatomic molecule in the semiclassical limit where...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the c...
Motivated by the paper [SW] by B.T. Sutcliffe and R.G. Woolley, we present the main ideas used by ma...
Motivated by the paper [SW1] by B.T. Sutcliffe and R.G. Woolley, we present the main ideas used by m...
When considering the work of Carl Ballhausen on vibrational spectra, it is suggested that his use of...
International audienceIn this paper, we use the Born-Oppenheimer approximation to study the elastic ...
We consider the eigenvalue problem for a one-dimensional molecular-type quantum Hamiltonian that has...
We present a rigorous derivation of classical molecular dynamics (MD) from quantum molecular dynami...
In this paper we analyze the evolution of the time averaged energy densities associatedwith a family...