Two approximations used by Sengupta [Phys. Rev. B {bf 100}, 075429 (2019)] in numerically computing the adsorption rate of cold hydrogen atoms on suspended graphene are critically examined. The independent boson model approximation (IBMA) was used to
compute the atom self-energy, and the single-pole approximation (SPA) was used to obtain the adsorption rate from the self-energy. It is shown explicitly that there are additional contributions to the self-energy appearing at the same order of the atom-phonon coupling as the IBMA terms that alter the value of the real part of the self-energy at low energies by several orders of magnitude in the regime of interest. This shift in the self-energy consequently renders the use of SPA invalid.
We consider a Hamiltonian description of the vibrations of a clamped, elastic circular plate. The Hamiltonian of this system features a potential energy with two distinct contributions: one that depends on the local mean curvature of the plate, and a
second that depends on its Gaussian curvature. We quantize this model using a complete, orthonormal set of eigenfunctions for the clamped, vibrating plate. The resulting quanta are the flexural phonons of the thin circular plate. As an application, we use this quantized description to calculate the fluctuations in displacement of the plate for arbitrary temperature. We compare the fluctuation profile with that from an elastic membrane under tension. At low temperature, we find that while both profiles have a circular ring of local maxima, the ring in the membrane profile is much more pronounced and sharper. We also note that with increasing temperature the plate profile develops two additional rings of extrema.
Results from four different approximations to the phonon-assisted quantum adsorption rate for cold atoms on a 2D material are compared and contrasted: (1) a loop expansion (LE) based on the atom-phonon coupling, (2) non-crossing approximation (NCA),
(3) independent boson model approximation (IBMA), and (4) a leading-order soft-phonon resummation method (SPR). We conclude that, of the four approximations considered, only the SPR method gives a divergence-free result in the large membrane regime at finite temperature. The other three methods give an adsorption rate that diverges in the limit of an infinite surface.
We investigate the topology of the spin-polarized charge density in bcc and fcc iron. While the total spin-density is found to possess the topology of the non-magnetic prototypical structures, in some cases the spin-polarized densities are characteri
zed by unique topologies; for example, the spin-polarized charge densities of bcc and high-spin fcc iron are atypical of any known for non-magnetic materials. In these cases, the two spin-densities are correlated: the spin-minority electrons have directional bond paths with deep minima in the minority density, while the spin-majority electrons fill these holes, reducing bond directionality. The presence of two distinct spin topologies suggests that a well-known magnetic phase transition in iron can be fruitfully reexamined in light of these topological changes. We show that the two phase changes seen in fcc iron (paramagnetic to low-spin and low-spin to high-spin) are different. The former follows the Landau symmetry-breaking paradigm and proceeds without a topological transformation, while the latter also involves a topological catastrophe.
The phonon-assisted sticking rate of slow moving atoms impinging on an elastic membrane at nonzero temperature is studied analytically using a model with linear atom-phonon interactions, valid in the weak coupling regime. A perturbative expansion of
the adsorption rate in the atom-phonon coupling is infrared divergent at zero temperature, and this infrared problem is exacerbated by finite temperature. The use of a coherent state phonon basis in the calculation, however, yields infrared-finite results even at finite temperature. The sticking probability with the emission of any finite number of phonons is explicitly seen to be exponentially small, and it vanishes as the membrane size grows, a result that was previously found at zero temperature; in contrast to the zero temperature case, this exponential suppression of the sticking probability persists even with the emission of an infinite number of soft phonons. Explicit closed-form expressions are obtained for the effects of soft-phonon emission at finite temperature on the adsorption rate. For slowly moving atoms, the model predicts that there is zero probability of sticking to a large elastic membrane at nonzero temperature and weak coupling.
We study the sticking rate of atomic hydrogen to suspended graphene using four different methods that include contributions from processes with multiphonon emission. We compare the numerical results of the sticking rate obtained by: (1) the loop expa
nsion of the atom self-energy, (2) the non-crossing approximation (NCA), (3) the independent boson model approximation (IBMA), and (4) a leading-order soft-phonon resummation method (SPR). The loop expansion reveals an infrared problem, analogous to the infamous infrared problem in QED. The 2-loop contribution to the sticking rate gives a result that tends to diverge for large membranes. The latter three methods remedy this infrared problem and give results that are finite in the limit of an infinite membrane. We find that for micromembranes (sizes ranging 100 nm to 10 $mu$m), the latter three methods give results that are in good agreement with each other and yield sticking rates that are mildly suppressed relative to the lowest-order golden rule rate. Lastly, we find that the SPR sticking rate decreases slowly to zero with increasing membrane size, while both the NCA and IBMA rates tend to a nonzero constant in this limit. Thus, approximations to the sticking rate can be sensitive to the effects of soft-phonon emission for large membranes.
Quantum electrodynamics (QED) provides a highly accurate description of phenomena involving the interaction of atoms with light. We argue that the quantum theory describing the interaction of cold atoms with a vibrating membrane--quantum acoustodynam
ics (QAD)--shares many issues and features with QED. Specifically, the adsorption of an atom on a vibrating membrane can be viewed as the counterpart to QED radiative electron capture. A calculation of the adsorption rate to lowest-order in the atom-phonon coupling is finite; however, higher-order contributions suffer from an infrared problem mimicking the case of radiative capture in QED. Terms in the perturbation series for the adsorption rate diverge as a result of massless particles in the model (flexural phonons of the membrane in QAD and photons in QED). We treat this infrared problem in QAD explicitly to obtain finite results by regularizing with a low-frequency cutoff that corresponds to the inverse size of the membrane. Using a coherent state basis for the soft phonon final state, we then sum the dominant contributions to derive a new formula for the multiphonon adsorption rate of atoms on the membrane that gives results that are finite, nonperturbative in the atom-phonon coupling, and consistent with the KLN theorem. For micromembranes, we predict a reduction with increasing membrane size for the low-energy adsorption rate. We discuss the relevance of this to the adsorption of a cold gas of atomic hydrogen on suspended graphene.
A continuum model for low-energy physisorption on a membrane under tension is proposed and studied with variational mean-field theory. A discontinuous change in the energy-dependent sticking coefficient is predicted under certain conditions. This sin
gularity is a result of the bosonic orthogonality catastrophe of the vibrational states of the membrane. The energy-dependent sticking coefficient is predicted to have exponential scaling in 1/E above the singularity. The application of this model to the quantum sticking of cold hydrogen to suspended graphene is discussed. The model predicts that a beam of atomic hydrogen can be completely reflected by suspended graphene at ultralow energies.
The sticking probability of cold atomic hydrogen on suspended graphene calculated by Lepetit and Jackson [Phys. Rev. Lett. {bf 107}, 236102 (2011)] does not include the effect of fluctuations from low-frequency vibrations of graphene. These fluctuati
ons suppress the sticking probability for low incident energies ($lesssim 15$ meV).
Using the theory of Zhang and Clougherty [Phys. Rev. Lett. 108, 173202 (2012)], we provide detailed supporting information concerning the numerical calculations of the probability ${it s}(E)$ for a low-energy electron with incident energy E adsorbing to the surface of nanoporous silicon.
