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We present systematic results, based on density functional calculations, for the structure and energetics of $^3$He and $^4$He nanodroplets doped with alkaline earth atoms. We predict that alkaline earth atoms from Mg to Ba go to the center…

Soft Condensed Matter · Physics 2016-09-28 A. Hernando , R. Mayol , M. Pi , M. Barranco , F. Ancilotto , O. Bünermann , F. Stienkemeier

We have experimentally studied the electronic $3p\leftarrow 3s$ excitation of Na atoms attached to $^3$He droplets by means of laser-induced fluorescence as well as beam depletion spectroscopy. From the similarities of the spectra…

Condensed Matter · Physics 2009-11-10 F. Stienkemeier , O. Bunermann , R. Mayol , F. Ancilotto , M. Barranco , M. Pi

We have studied the structure of $^4$He droplets doped with magnesium atoms using density functional theory. We have found that the solvation properties of this system strongly depend on the size of the $^4$He droplet. For small drops, Mg…

Other Condensed Matter · Physics 2008-07-14 Alberto Hernando , Manuel Barranco , Ricardo Mayol , Marti Pi , Francesco Ancilotto

We have experimentally studied the electronic $3p\leftarrow 3s$ excitation of Na atoms attached to $^3$He droplets by means of laser-induced fluorescence as well as beam depletion spectroscopy. From the similarities of the spectra…

Other Condensed Matter · Physics 2007-05-23 F. Stienkemeier , O. Bünermann , R. Mayol , F. Ancilotto , M. Barranco , M. Pi

We have experimentally studied the electronic $3p-> 3s$ excitation of Na atoms attached to $^3$He droplets by means of laser-induced fluorescence as well as beam depletion spectroscopy. From the similarities of the spectra (width/shift of…

Soft Condensed Matter · Physics 2009-11-10 R. Mayol , F. Ancilotto , M. Barranco , O. Bünermann , M. Pi , F. Stienkemeier

The mechanism of ionization of helium droplets has been investigated in numerous reports but one observation has not found a satisfactory explanation: How are $He^+$ ions formed and ejected from undoped droplets at electron energies below…

Atomic and Molecular Clusters · Physics 2016-11-30 Michael Renzler , Matthias Daxner , Nikolaus Weinberger , Stephan Denifl , Paul Scheier , Olof Echt

Within the diffusion Monte Carlo approach, we have determined the structure of isotopically pure and mixed helium droplets doped with one magnesium atom. For pure 4He clusters, our results confirm those of M. Mella et al. [J. Chem. Phys.…

Other Condensed Matter · Physics 2015-06-03 J. Navarro , D. Mateo , M. Barranco , A. Sarsa

We investigate the behavior of mixed 3He-4He droplets on alkali surfaces at zero temperature, within the frame of Finite Range Density Functional theory. The properties of one single 3He atom on 4He_N4 droplets on different alkali surfaces…

Superconductivity · Physics 2009-11-10 M. Barranco , M. Guilleumas , E. S. Hernandez , R. Mayol , M. Pi , L. Szybisz

The solvation process of an alkali ion (Na$^+$, K$^+$, Rb$^+$, Cs$^+$) inside a superfluid $^4$He$_{2000}$ nanodroplet is investigated theoretically using liquid $^4$He time-dependent density functional theory at zero temperature. We…

Atomic and Molecular Clusters · Physics 2025-07-22 Ernesto García-Alfonso , Manuel Barranco , Martí Pi , Nadine Halberstadt

Investigating atom-surface interactions is the key to an in-depth understanding of chemical processes at interfaces, which are of central importance in many fields -- from heterogeneous catalysis to corrosion. In this work, we present a…

Chemical Physics · Physics 2023-12-18 Martin Liebetrau , Yvonne Dorenkamp , Oliver Bünermann , Jörg Behler

We investigate the solvation of methane and methane decorated with charges in spherically confined water droplets. Free energy profiles for a single methane molecule in droplets, ranging in diameter D, from 1 to 4 nm, show that the droplet…

Chemical Physics · Physics 2009-09-29 S. Vaitheeswaran , D. Thirumalai

Recently, it was shown how the primary steps of solvation of a single Na$^+$ ion, instantly created at the surface of a nanometer-sized droplet of liquid helium, can be followed at the atomic level [Albrectsen et al. Nature $\textbf{623}$,…

Within density functional theory, we have obtained the structure of $^4$He droplets doped with neutral calcium atoms. These results have been used, in conjunction with newly determined {\it ab-initio} $^1\Sigma$ and $^1\Pi$ Ca-He pair…

Soft Condensed Matter · Physics 2009-11-13 Alberto Hernando , Manuel Barranco , Marek Krośnicki , Ricardo Mayol , Martí Pi

In 2023, ultrafast pump-probe spectrocopy was used to record the solvation dynamics of a single Na$^+$ ion in a liquid helium droplet, atom-by-atom and with femtosecond time resolution [Albrechtsen \textit{et al., Nature}, 2023,…

We investigated the impact of surface oxygen on the ion yield for He$^+$ ions scattered from different single crystalline surfaces in low-energy ion scattering. Initially clean Al(111) and Ta(111) were exposed to molecular oxygen and ion…

Materials Science · Physics 2019-09-18 Barbara Bruckner , Peter Bauer , Daniel Primetzhofer

Helium nanodroplets are widely used as a cold, weakly interacting matrix for spectroscopy of embedded species. In this work we excite or ionize doped He droplets using synchrotron radiation and study the effect onto the dopant atoms…

Mixed $^3$He-$^4$He droplets created by hydrodynamic instability of a cryogenic fluid-jet may acquire angular momentum during their passage through the nozzle of the experimental apparatus. These free-standing droplets cool down to very low…

Quantum Gases · Physics 2020-08-12 Marti Pi , Francesco Ancilotto , Jose' Maria Escartin , Ricardo Mayol , Manuel Barranco

The dynamics following the photoexcitation of Na and Li atoms located on the surface of helium nanodroplets has been investigated in a joint experimental and theoretical study. Photoelectron spectroscopy has revealed that excitation of the…

Atomic and Molecular Clusters · Physics 2017-08-23 Alberto Hernando , Manuel Barranco , Martí Pi , Evgeniy Loginov , Marina Langlet , Marcel Drabbels

Recent measurements of the scattering of He and Ne atoms at Rh(110) suggest that these two rare-gas atoms measure a qualitatively different surface corrugation: While Ne atom scattering seemingly reflects the electron-density undulation of…

Photoionization spectroscopy and mass spectrometry of doped helium (He) nanodroplets rely on the ability to efficiently detect ions and/or electrons. Using a commercial quadrupole mass spectrometer and a photoelectron-photoion coincidence…

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