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Photoionization cross section of the fullerene ion C60+ has been calculated within a single-electron approximation and also by using a consistent many-body theory accounting for many-electron correlations.

Atomic and Molecular Clusters · Physics 2016-09-20 R. G. Polozkov , V. K. Ivanov , A. V. Solov'yov

Considering C$_{60}$ as a model system for describing field emission from the extremity of a carbon nanotip, we explore electron emission from this fullerene excited by an intense, near-infrared, few-cycle laser pulse…

Atomic and Molecular Clusters · Physics 2016-03-23 Cong-Zhang Gao , Phuong Mai Dinh , Peter Kluepfel , Chris Meier , Paul-Gerhard Reinhard , Eric Suraud

We show that additional features can emerge in the linear absorption spectra of homonuclear diatomic molecules when the ions are described quantum mechanically. In particular, the widths and energies of the peaks in the optical spectra…

Atomic and Molecular Clusters · Physics 2015-03-26 A. Crawford-Uranga , D. J. Mowbray , D. M. Cardamone

Our previous studies [J. Phys. B 53, 125101 (2020); Euro. Phys. J. D 74, 191 (2020)] have predicted that the atom-fullerene hybrid photoionization properties for X = Cl, Br and I endohedrally confined in C60 are different before and after…

Atomic and Molecular Clusters · Physics 2022-03-14 Esam Ali , Taylor O'Brien , Andrew Dennis , Mohamed El-Amine Madjet , Steven T. Manson , Himadri S. Chakraborty

Photoionization cross sections, photoelectron angular-asymmetry parameters and photoionization time delays for $A$@C$_{60}$ endohedral atoms are studied with account for both the individual and combined effects of dipole static polarization…

Atomic Physics · Physics 2018-09-11 V. K. Dolmatov

We demonstrate the role played by the fullerene shell in the photoionization and vacancy decay of endohedral atoms A@C60. It is shown, partly in the frame of a rather simple model that describes the fullerene shell, partly using only the…

Chemical Physics · Physics 2007-05-23 M. Ya. Amusia

Photoionization of two buckyonions, C$_{60}$@C$_{240}$ and C$_{20}$@C$_{60}$, is investigated by means of time-dependent density-functional theory (TDDFT). The TDDFT-based photoabsorption spectrum of C$_{60}$@C$_{240}$, calculated in a…

Atomic and Molecular Clusters · Physics 2016-10-26 Alexey Verkhovtsev , Andrei V. Korol , Andrey V. Solov'yov

Intense X-ray photo-absorption from short and intense pulses by a molecule triggers complicated electron and subsequently ion dynamics leading to photo-electron spectra which are difficult to interpret. Illuminating fullerenes offers a way…

Atomic and Molecular Clusters · Physics 2014-08-20 Abraham Camacho Garibay , Ulf Saalmann , Jan M. Rost

We study the photoionization properties of the C_60 versus C_240 molecule in a spherical jellium frame of density functional method. Two different approximations to the exchange-correlation (xc) functional are used: (i) The…

Atomic and Molecular Clusters · Physics 2021-06-08 Jinwoo Choi , EonHo Chang , Dylan M. Anstine , Mohamed El-Amine Madjet , Himadri S. Chakraborty

We have observed that C$_{60}^+$ ions isolated in cryogenic matrixes show pronounced near-IR photoluminescence upon excitation in the near-IR range. By contrast UV photoexcitation does not lead to measurable luminescence. After the recent…

Chemical Physics · Physics 2017-09-20 Dmitry Strelnikov , Bastian Kern , Manfred M. Kappes

We have calculated photoionization cross-section of endohedral atoms A@CN. We took into account the polarizability of the fullerene electron shell CN that modifies the incoming photon beam and the one-electron wave functions of the caged…

Atomic and Molecular Clusters · Physics 2019-03-27 M. Ya. Amusia , L. V. Chernysheva

Recent direct experimental observation of multiple highly-dispersive C$_{60}$ valence bands has allowed for a detailed analysis of the unique photoemission traits of these features through photon energy- and polarization-dependent…

Mesoscale and Nanoscale Physics · Physics 2023-01-18 Drew W. Latzke , Claudia Ojeda-Aristizabal , Jonathan D. Denlinger , Ryan Reno , Alex Zettl , Alessandra Lanzara

The remarkable physical properties of buckminsterfullerene, C$_{60}$, have attracted intense research activity since its original discovery. Total quantum state resolved measurements of isolated C$_{60}$ molecules have been of particularly…

Chemical Physics · Physics 2019-03-06 P. Bryan Changala , Marissa L. Weichman , Kevin F. Lee , Martin E. Fermann , Jun Ye

The optical interference constitutes a paramount resource in modern physics. At the scale of individual atoms and photons, it is a diverse concept that causes different coherent phenomena. We present the experimental characterization of…

Quantum Physics · Physics 2022-09-21 A. Kovalenko , D. Babjak , A. Lešundák , L. Podhora , L. Lachman , P. Obšil , T. Pham , O. Číp , R. Filip , L. Slodička

In this work, we investigate the photoionization cross-section of an electron confined in a quantum dot, considering the position-dependent variation of the effective mass through the parameter $\gamma$. We used a theoretical model based on…

The decay of photoexcited quantum systems (examples are photodissociation of molecules and autoionization of atoms) can be viewed as a half-collision process (an incoming photon excites the system which subsequently decays by dissociation…

Disordered Systems and Neural Networks · Physics 2009-11-10 T. Gorin , B. Mehlig , W. Ihra

When an atom or molecule absorbs a high-energy photon, an electron is emitted with a well-defined energy and a highly-symmetric angular distribution, ruled by energy quantization and parity conservation. These rules seemingly break down…

Using $He@C_{60}$ as an example, we demonstrate that static potential of the fullerene core essentially alters the cross section of the two-electron ionization differential in one-electron energy $d\sigma ^{++}(\omega )/d\epsilon $. We…

Atomic Physics · Physics 2009-11-11 M. Ya. Amusia , E. Z. Liverts , V. B. Mandelzweig

In this paper, we present a theoretical investigation of photoabsorption spectrum of the newly synthesized hydrogenated cluster of aluminium, Al4H6. The calculations are performed within the wave-function-based semi-empirical method…

Atomic and Molecular Clusters · Physics 2010-01-10 Sridhar Sahu , Alok Shukla

Using a combination of semiclassical and recently developed wave packet propagation techniques we find the quantum self-ionization process of highly excited ions moving in magnetic fields which has its origin in the energy transfer from the…

Atomic Physics · Physics 2009-11-06 Vladimir Melezhik , Peter Schmelcher
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