activity
20052023
most citedMachine learning force fields and coarse-grained variables in molecular dynamics: application to materials and biological systems

230 citations · 1.3k across the 68 of their papers we have counts for

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Showing 2009Show all

6 papers · 1 filter

cond-mat.stat-mech2009★ 22 cited

Thermal conductivity of the Toda lattice with conservative noise

Alessandra Iacobucci, Frederic Legoll, Stefano Olla +1

We study the thermal conductivity of the one dimensional Toda lattice perturbed by a stochastic dynamics preserving energy and momentum. The strength of the stochastic noise is con…

cond-mat.stat-mech2009

Free energy calculations: An efficient adaptive biasing potential method

Bradley M. Dickson, Frederic Legoll, Tony Lelievre +2

We develop an efficient sampling and free energy calculation technique within the adaptive biasing potential (ABP) framework. By mollifying the density of states we obtain an appro…

cond-mat.mtrl-sci2009★ 19 cited

Reducing the thermal conductivity of carbon nanotubes below the random isotope limit

Gabriel Stoltz, Natalio Mingo, Francesco Mauri

We find that introducing segmented isotopic disorder patterns may considerably reduce the thermal conductivity of pristine carbon nanotubes below the uncorrelated disorder value. T…

cond-mat.str-el2009★ 20 cited

The many-body Green function of degenerate systems

Christian Brouder, Gianluca Panati, Gabriel Stoltz

A rigorous non perturbative adiabatic approximation of the evolution operator in the many-body physics of degenerate systems is derived. This approximation is used to solve the lon…

math-ph2009★ 16 cited

Gell-Mann and Low formula for degenerate unperturbed states

Christian Brouder, Gianluca Panati, Gabriel Stoltz

The Gell-Mann and Low switching allows to transform eigenstates of an unperturbed Hamiltonian into eigenstates of the modified Hamiltonian . This switching can be pe…

cond-mat.stat-mech2009★ 7 cited

Constant entropy sampling and release waves of shock compressions

Jean-Bernard Maillet, Emeric Bourasseau, Laurent Soulard +2

We present several equilibrium methods that allow to compute isentropic processes, either during the compression or the release of the material. These methods are applied to comput…