Crystal effects in the neutralization of He+ ions in the low energy ion scattering regime

Investigating possible crystal effects in ion scattering from elemental surfaces, measurements of the positive ion fraction P+ are reported for He+ ions scattered from single and polycrystalline Cu surfaces. In the Auger neutralization regime, the ion yield is determined by scattering from the outermost atomic layer. For Cu(110) P+ exceeds that for polycrystalline Cu by up to a factor of 2.5, thus exhibiting a strong crystal effect. It is much less pronounced at higher energies, i.e., in the reionization regime. However, there a completely different angular dependence of the ion yield is observed for poly- and single crystals, due to massive subsurface contributions in nonchanneling directions.     

Velocity scaling of ion neutralization in low energy ion scattering

The ion fraction P+ is measured for He+ ions scattered by 129 degrees from a Cu surface. Both the primary energy and the angles of incidence and of exit are varied. From our results we conclude the following: along the incoming and outgoing trajectories, neutralization is due to Auger processes and depends on the normal velocity component v( perpendicular ) only. At higher energies, additional charge exchange is due to collision induced neutralization and reionization, both depending on the total ion energy only. Also in this regime P+ depends on v( perpendicular ), but via a two-valued function of the scattering geometry at fixed energy.     

Dependence of scattered ion yield on the incident energy: Ne on pure gallium and indium

An experimental study of the ion yield dependence on the incident energy (0.4-2.2 keV) for Ne⁺ isotopes scattered at 120° from pure gallium and indium targets has been carried out by mass-resolved ion-scattering spectrometry. For both two targets, the ion yield curves exhibited a broad maximum below 0.8-1 keV (with a lower position for Ne⁺ on In) followed by a monotonous decrease yield without any oscillatory features. The energy dependence of ion-survival probability was explained as a complex interplay of the Auger neutralization with the characteristic velocity v_c=(0.9±0.1)×10⁷ cm/s for Ne⁺ on Ga, and the collision-induced neutralization and reionization. The later ones were significant processes at the energies larger than 0.8-1.0 keV or, in terms of the distance of closest approach, d?0.5-0.55 Å; the collision-induced neutralization was more effective than the inverse process. No visible influence of isotope effect on charge exchange was found. The ion-survival probability versus the inverse ion velocity displayed an independence on the mass of Ne⁺ projectiles.     

Interactions of relativistic heavy ions in thick heavy element targets and some unresolved problems

Interactions of relativistic heavy ions with total energies above 30 GeV in thick Cu and Pb targets (≥ 2 cm) have been studied with various techniques. Radiochemical irradiation experiments using thick Cu targets, both in a compact form or as diluted “2π-Cu targets” have been carried out with several relativistic heavy ions, such as 44 GeV ¹²C (JINR, Dubna, Russia) and 72 GeV ⁴⁰Ar (LBL, Berkeley, USA). Neutron measuring experiments using thick targets irradiated with various relativistic heavy ions up to 44 GeV ¹²C have been performed at the JINR. In addition, the number of “black prongs” in nuclear interactions (due to protons with energies less than 30 MeV and emitted from the target-like interaction partner at rest) produced with 72 GeV ²²Ne ions in nuclear emulsion plates has been measured in the first nuclear interaction of the primary ²²Ne ion and in the following second nuclear interaction of the secondary heavy (Z > 1) ion. Some essential results have been obtained. (1) Spallation products produced by relativistic secondary fragments in interactions ([44 GeV ¹²C or 72 GeV ⁴⁰Ar] + Cu) within thick copper yield fewer products close to the target and many more products far away from the target as compared to primary beam interactions. This applies also to secondary particles emitted into large angles (Θ > 10°). (2) The neutron production of 44 GeV ¹²C within thick Cu and Pb targets is beyond the estimated yield as based on experiments with 12 GeV ¹²C. These rather independent experimental results cannot be understood within well-accepted nuclear reaction models. They appear to present unresolved problems. The text was submitted by the authors in English.     

Interaction of low energy (5–10 keV) argon atoms and ions with a Cu(100) surface; Ion fraction,ionization and neutralization

The ion fractions η⁺ of low energy (5–10 keV) argon particles scattered from a Cu(100) surface, are measured with a time of flight spectrometer. Neutral as well as charged projectiles are used. The scattering angle θ is 30°. The results for different angles of incidence ψ and crystal directions are reported. For scattering in the 〈100〉 direction, with a ψ-value of 15° and a primary energy E₀ of 5 and 10 keV, the ion fractions for the quasi single scattering peak, η⁺_QS, are 1.5 and 6.1% respectively. When E₀ is between 5 and 10 keV a reionization process with a constant reionization probability occurs during the violent interaction. This process, but also neutralization along the outgoing trajectory, determines η⁺_QS. With ions as projectiles, an energy difference of about 16 eV is observed between the quasi single scattering peaks in the spectra of all scattered particles and of ions only. The ion fraction for the quasi double scattering peak, η⁺_QD. depends largely upon E₀, indicating that the efficiency of the reionization process increases with E₀. A qualitative discussion of the data is given, using the reionization process and the interatomic neutralization processes along the trajectory of the scattered particles.     

The16O(d,n)17F reaction at deuteron energies from 2.5 to 5.5 MeV

The¹⁶O(d, n)¹⁷F transitions to the ground state and to the first excited state were studied in the deuteron energy range 2.5–5.5 MeV. Time-of-flight techniques and gas targets were used. Differential cross sections in the angular range 0–160? at deuteron energies from 3.0 to 5.5 MeV in steps of 0.5 MeV were recorded as well as yield curves at 0 and 30? from 2.5 to 5.5 MeV in steps of 100 keV. DWBA calculations using seven different deuteron optical potentials were performed. It is found that the spectroscopic factors depend strongly on the choice of deuteron optical potential. The ratio between the spectroscopic factors for the ground state and for the first excited state varies between 0.9 and 1.7 for various choices. The most straightforward choice gives the ratio 1.4. Similar studies at higher deuteron energies have yielded ratios close to unity.     

Intense laser-cluster interaction in the strong coupling regime

The interaction of noble gas clusters with moderately intense laser radiation at 100 and 800 nm is investigated via molecular dynamics simulations. It is shown that the laser-cluster interaction creates a strongly coupled plasma, which is characterized by a dominance of collisional processes. This has led to several findings. (1) A new heating mechanism is identified that explains the observation of unusually high-charge states in recent experiments with 100 nm radiation at DESY. We find that energy absorption takes place in the following cycle: many-body collisions resulting in an enhanced recombination of free electrons to exited states, and subsequent reionization. (2) Cluster interaction with 800 nm radiation is a promising system for investigating the transition from weakly coupled plasmas, where collective processes dominate, to strongly coupled plasmas. We achieve this transition by varying a single parameter: the laser intensity. The experimental and theoretical accessibility of laser-cluster interaction, thus, allows a systematic combined study of the interplay between collective and collisional processes.     

Gas-phase doubly charged complexes of cyclic peptides with copper in +1, +2 and +3 formal oxidation states: formation, structures and electron capture dissociation

Copper complexes with a cyclic D-His-β-Ala-L-His-L-Lys and all-L-His-β-Ala-His-Lys peptides were generated by electrospray which were doubly charged ions that had different formal oxidation states of Cu(I), Cu(II) and Cu(III) and different protonation states of the peptide ligands. Electron capture dissociation showed no substantial differences between the D-His and L-His complexes. All complexes underwent peptide cross-ring cleavages upon electron capture. The modes of ring cleavage depended on the formal oxidation state of the Cu ion and peptide protonation. Density functional theory (DFT) calculations, using the B3LYP with an effective core potential at Cu and M06-2X functionals, identified several precursor ion structures in which the Cu ion was threecoordinated to pentacoordinated by the His and Lys side-chain groups and the peptide amide or enolimine groups. The electronic structure of the formally Cu(III) complexes pointed to an effective Cu(I) oxidation state with the other charge residing in the peptide ligand. The relative energies of isomeric complexes of the [Cu(c-HAHK + H)](2+) and [Cu(c-HAHK - H)](2+) type with closed electronic shells followed similar orders when treated by the B3LYP and M06-2X functionals. Large differences between relative energies calculated by these methods were obtained for open-shell complexes of the [Cu(c-HAHK)](2+) type. Charge reduction resulted in lowering the coordination numbers for some Cu complexes that depended on the singlet or triplet spin state being formed. For [Cu(c-HAHK - H)](2+) complexes, solution H/D exchange involved only the N-H protons, resulting in the exchange of up to seven protons, as established by ultra-high mass resolution measurements. Contrasting the experiments, DFT calculations found the lowest energy structures for the gas-phase ions that were deprotonated at the peptide C(α) positions.     

Production of ion and electron streams by pulsed-laser ablation of Ta and Cu

A Nd:YAG laser with 10⁹ W/cm ² pulse intensity, operating at 532 nm wavelength, is used to ablate Ta and Cu targets placed in vacuum. The ablation process generates a plasma in front of the target surface, which expands along the normal to target surface. The ion and electron emissions from the plasma were measured by Faraday cups placed at different angles with respect to the normal to target surface. In the range of laser intensities from 10⁷ to 10⁹ W/cm², the fast electron yield is lower than the ion yield and it increases at higher laser intensities. The ablation threshold, the emission yield, the ion and electron average energies and the plasma ion and electron temperatures were measured for ion and fast electron streams.     

Photoelectron spectroscopy of Ar/Cu(100) interface states

Buried interface states in Ar/Cu(100) were studied by means of one- and two-photon photoemission experiments. With increasing Ar overlayer thickness, a transition from broad electron scattering resonances in the Ar conduction band into a hydrogen-like series of quasi-bound states at the Ar/Cu interface was observed. The thickness dependence of energies and lifetimes is compared to theoretical resonance positions and linewidths derived from a parameterized one-dimensional potential. PACS 73.20.-r; 73.40.Ns; 79.60.-i; 78.47.+p     

The measurement of energy spectra of neutral particles in low energy ion scattering

An apparatus is described for low energy (0.1–10 keV) ion scattering (LEIS) experiments. A time of flight (TOF) spectrometer is incorporated in the system to be able to measure the energy of particles in the neutral state after scattering. The energy resolution ΔE/E of the TOF spectrometer is discussed and found to be 0.5% (FWHM). This is sufficient for our scattering experiments. An electrostatic analyzer (ESA) is used to measure the energy of scattered ions [ΔE/E=0.5% (FWHM)]. Experiments show that in general the ion dose needed to obtain a TOF spectrum (2×10¹⁰ ions/cm²) is much smaller than the dose needed for an ESA-spectrum (6×10¹³ ions/cm²). The ion spectra measured with the TOF spectrometer, by subtracting the neutral yield from the total yield, as well as with the ESA are found to agree quite well. This provides a way to calibrate the TOF spectrometer. The determination of the ion fraction of scattered particles is discussed [10 keV⁴⁰Ar⁺ on Cu(100), scattering angle 30°]. It is shown that the TOF spectrometer is able to measure light recoil particles (e.g. hydrogen) from a heavy substrate. In the analysing system is, in addition to the TOF spectrometer, also incorporated a stripping cell to measure the energy of neutral scattered particles. An energy spectrum of neutral scattered particles measured with both methods is shown.     

Velocity Distributions of Copper and Lithium Atoms Sputtered from a Cu/Li Alloy Measured with Laser Induced Fluorescence

To test its applicability as wall material for nuclear fusion experiments, a copper based binary alloy containing 17 at.% of lithium has been bombarded with a monoenergetic mass-analyzed 6 keV argon ion beam at target temperatures close to room temperature. The velocity distributions of both constituents have been measured by means of laser induced fluorescence. Mean surface binding energies of 2.2 eV for the Li component and 2.4 eV for the Cu component have been derived from the experimental data, while 3.5 eV are obtained for a pure copper target. A comparison of the energies indicates only a moderate lithium enrichment in the first few atomic surface layers of the alloy under irradiation. Furthermore, mean transport velocities of the sputtered particles have been calculated.     

Amorphous solid foam structures on germanium by heavy ion irradiation

Ge (100) surfaces were irradiated by heavy Bi⁺ and Bi⁺⁺ ions extracted from a Bi-liquid metal ion source in a mass separated focused ion beam system with energies of 30 and 60 keV, respectively. Networks of different nanoporous (or sponge like) structures were found depending on ion energy, fluence, angle of incidence, and irradiation temperature. The porous and amorphous surface structures are explained in terms of high concentration vacancies close to the surface. The surface modification was investigated using SEM and AFM imaging and FIB for cross section preparation.     

Angular dependence of the scattered ion yields in 4He+ → Cu scattering spectrometry

Assuming long range charge exchange mechanisms and neglecting shadowing effects, theory predicts the variation of the scattered ion yield with the scattering angle θ and the incidence angle ψ for some well defined experimental conditions. Such measurements were performed for ⁴He⁺ scattering on polycrystalline copper at incident energies ranging from 0.5 to 1.25 keV and at scattering angles from 20° to 130°. It is suggested that shadowing effects should be taken into account in order to explain the observed behaviour.     

Analysis of the interactions between He+ ions and transition metal surfaces using co-axial impact collision ion scattering spectroscopy

The interactions between low energy He⁺ ions and a series of transition metal surfaces have been studied using co-axial impact collision ion scattering spectroscopy (CAICISS). Experimental data were collected from the Ni(110), Cu(100), Pd(111), Pt(111) and Au(111) surfaces using ion beams with primary energies between 1.5 keV and 4.0 keV. The shadow cone radii deduced from the experimental surface peak positions were found to closely match theoretical predictions. Data analysis was performed using both the FAN and Kalypso simulation codes, revealing a consistent requirement for a reduction of 0.252 in the screening length correction in the Molière approximation within the Thomas–Fermi (TFM) interaction potential. The adjustments of the screening length in the TFM potential, predicted by O'Connor, and the uncorrected Ziegler–Biersack–Littmark (ZBL) potential both yielded inaccurate results for all of the surfaces and incident energies studied. We also provide evidence that, despite their different computational methodologies, the FAN and Kalypso simulation codes generate similar results given identical input parameters for the analysis of 180° backscattering spectra.     

Molecular dynamics simulation of the interaction of low-energy copper,silver and gold clusters with a Cu(100) surface

The interaction process of low-energy copper, silver and gold clusters of different sizes (13, 27 and 39 atoms) and different energies of translational motion (100, 200, and 400 eV) with a Cu(100) surface has been investigated in the framework of classic molecular dynamics. A comparative analysis of the processes of atomic mixing and adsorption layer (adlayer) formation has been performed for bombarding clusters of different types, sizes, and translational motion energies.     

Resonant electron exchange scattering in late transition metal monoxides

Intra-atomic d-d transitions in NiO(100) and CoO(100) have been investigated with angle-resolved electron energy loss spectroscopy (EELS) at primary energies close to the metal 3s excitation threshold. Electron exchange scattering was found to be resonantly enhanced at the 3s threshold due to the temporary formation of a negative ion core state and its subsequent decay via Auger-like transitions. In both oxides the threshold is lowered several eV due to a strong electron- core hole interaction. Angle-dependent studies reveal a different dependency of exchange processes on the scattering angle as compared with nonresonant measurements and reveal a different angle dependence for each specific d-d transition. It is suggested that in these oxides large-angle single-step inelastic scattering contributes significantly to the EELS measurements in reflection mode.     

Cu(100)表面c(2×2)-N原子结构与吸附行为研究

用密度泛函理论的总能计算研究了金属铜(100)面的表面原子结构以及氮原子的c(2×2)吸附状态.研究结果表明：在Cu(100) c(2×2)-N表面系统中，氮原子处于四度配位的空洞(FFH)位置，距离最表面铜原子层的垂直距离为0.20?，最短的Cu—N键长度为1.83?.结构优化的计算否定了被吸附物导致的表面再构模型，即c(2×2)元胞的两个铜原子在垂直于表面方向发生相对位移，一个铜原子运动到氮原子之上的模型.该吸附表面的功函数约为4.65eV, 氮原子的平均吸附能为4.92 eV(以孤立氮原子为能量参考点).计算结果还说明，Cu—N杂化形成的表面局域态的位置在费米面以下约1.0 eV附近出现，氮原子和第一层以及第二层铜原子均有不同程度的杂化作用.该结果为最近有关该表面的STM图像的争论提供了判据性的第一性原理计算结果. 关键词： Cu(100) c(2×2)-N 表面吸附态 密度泛函总能计算     

Band structure effects in high energy ion beam surface interaction at grazing incidence

The analysis of charge state distributions after the interaction of fast Li- and N-ions with a surface at grazing incidence at energies between 50 and 350 keV yields for Li a strongly suppressed and for N an enhanced fraction of neutrals in comparison to the beam-foil interaction. These findings are supported by corresponding alkali-spectra which are dominated by lines from transitions in singly ionized atoms. The experiments are consistently interpreted in terms of a two step model: (1) collisional excitation in the close vicinity of the surface and (2) modification of this population by resonant electron transfer from (to) non localized states in the conduction (valence) band to (from) the ion. The model is also applied to interpret recent beam-foil experiments where preferential populations of Rydberg levels in highly ionized atoms were found.     

Quantitative auger electron analysis of homogeneous binary alloys: Chromium in gold

Quantitative Auger electron analysis of Cr/Au alloys with up to 20% Cr has been accomplished. The surface composition of scribed areas were compared to bulk compositions and it was shown that corrections for variation of density, escape depth, and electron backscattering must be included; these corrections change the measured surface Cr concentrations by approximately 15%. Alloy sputter yield ratios have been calculated from surface concentrations after sputtering with Ar or Ne (0.5, 1.0, 1.5, and 2.0 keV). The sputter yield ratio of Cr to Au was 0.5 at 1% Cr (significant preferred sputtering) but was near unity at 20% Cr (no preferred sputtering). The sputter yield ratio was nearly independent of ion species and ion energy. The 2 keV argon ion sputter yields for pure Cr and Au were determined to be 2.0 and 7.9 atoms/ion, respectively. However, the 2 keV argon ion sputter yield for Au in the alloys drops rapidly from 7.9 atoms/ion for pure Au, to 5 atoms/ion at 10–20% Cr. The sputter yield for Cr in alloys (5 atoms/ion) is relatively independent of composition and is 2.5 times higher than the yield of pure Cr. No simple model is known by which pure elements sputter yields could be used to predict alloy sputtering behavior.