Yu-hui Chiu

Passive Optical Diagnostic of Xe-Propelled Hall Thrusters. II. Collisional-Radiative Model

A collisional radiative model is presented for analyzing the xenon-propelled Hall thruster optical radiation based on apparent electron and ion-impact emission cross sections associated with lines in the visible and near-infrared region of the spectrum. The emission cross sections of selected near-infrared emission lines are incorporated in a collisional-radiative model. The effect of stepwise excitation via metastable states on the derived line intensities for emissions from XeI 5p56p(6p′) levels is evaluated. Meanwhile, visible XeII emissions are shown to provide plasma densities at high electron temperature conditions. The electron temperature and spatial ion number density distribution were determined from the luminescence spectra measured in the discharge and plume near-field plasma of the Hall thruster, the TSNIIMASH D-55 anode layer thruster. The results are in good agreement with the probe measurement data and simulations reported in the literature for the same thruster. The analysis of the Hall t...

Passive optical diagnostic of Xe-propelled Hall thrusters. I. Emission cross sections

This paper presents a set of xenon apparent emission excitation cross sections for emission lines that have diagnostic value in the analysis of Xe-propelled Hall thruster plasmas. Emission cross sections are presented for three excitation processes involving ground-state xenon atoms: e−+Xe, Xe++Xe, and Xe2++Xe. The cross sections are derived from luminescence spectra produced at single-collision conditions. Apparent emission excitation cross sections are tabulated for 12 visible and 8 near-infrared lines for electron energies ranging from 10to70eV. In case of the near-infrared lines, radiation trapping effects are accounted for by measuring the detailed pressure dependence of the apparent emission cross sections and extrapolating to zero pressure. A semiempirical expression for the pressure dependence is derived that allows zero-pressure extrapolation from threshold to 70eV. Ion-induced cross sections are reported for the same emission lines at an energy per unit charge E∕q of 300eV, chosen for typical Ha...

A pulsed-field ionization photoelectron secondary ion coincidence study of the H2+(X,υ+=0–15,N+=1)+He proton transfer reaction

The endothermic proton transfer reaction, H2+(upsilon+)+He-->HeH+ + H(DeltaE=0.806 eV), is investigated over a broad range of reactant vibrational levels using high-resolution vacuum ultraviolet to prepare reactant ions either through excitation of autoionization resonances, or using the pulsed-field ionization-photoelectron-secondary ion coincidence (PFI-PESICO) approach. In the former case, the translational energy dependence of the integral reaction cross sections are measured for upsilon+=0-3 with high signal-to-noise using the guided-ion beam technique. PFI-PESICO cross sections are reported for upsilon+=1-15 and upsilon+=0-12 at center-of-mass collision energies of 0.6 and 3.1 eV, respectively. All ion reactant states selected by the PFI-PESICO scheme are in the N+=1 rotational level. The experimental cross sections are complemented with quasiclassical trajectory (QCT) calculations performed on the ab initio potential energy surface provided by Palmieri et al. [Mol. Phys. 98, 1839 (2000)]. The QCT cross sections are significantly lower than the experimental results near threshold, consistent with important contributions due to resonances observed in quantum scattering studies. At total energies above 2 eV, the QCT calculations are in excellent agreement with the present results. PFI-PESICO time-of-flight (TOF) measurements are also reported for upsilon+=3 and 4 at a collision energy of 0.6 eV. The velocity inverted TOF spectra are consistent with the prevalence of a spectator-stripping mechanism.

The study of state-selected ion-molecule reactions using the vacuum ultraviolet pulsed field ionization-photoion technique

This paper presents the methodology to generate beams of ions in single quantum states for bimolecular ion-molecule reaction dynamics studies using pulsed field ionization (PFI) of atoms or molecules in high-n Rydberg states produced by vacuum ultraviolet (VUV) synchrotron or laser photoexcitation. Employing the pseudocontinuum high-resolution VUV synchrotron radiation at the Advanced Light Source as the photoionization source, PFI photoions (PFI-PIs) in selected rovibrational states have been generated for ion-molecule reaction studies using a fast-ion gate to pass the PFI-PIs at a fixed delay with respect to the detection of the PFI photoelectrons (PFI-PEs). The fast ion gate provided by a novel interleaved comb wire gate lens is the key for achieving the optimal signal-to-noise ratio in state-selected ion-molecule collision studies using the VUV synchrotron based PFI-PE secondary ion coincidence (PFI-PESICO) method. The most recent development of the VUV laser PFI-PI scheme for state-selected ion-molecule collision studies is also described. Absolute integral cross sections for state-selected H2+ ions ranging from v+ = 0 to 17 in collisions with Ar, Ne, and He at controlled translational energies have been obtained by employing the VUV synchrotron based PFI-PESICO scheme. The comparison between PFI-PESICO cross sections for the H2+(HD+)+Ne and H2+(HD+)+He proton-transfer reactions and theoretical cross sections based on quasiclassical trajectory (QCT) calculations and three-dimensional quantum scattering calculations performed on the most recently available ab initio potential energy surfaces is highlighted. In both reaction systems, quantum scattering resonances enhance the integral cross sections significantly above QCT predictions at low translational and vibrational energies. At higher energies, the agreement between experiment and quasiclassical theory is very good. The profile and magnitude of the kinetic energy dependence of the absolute integral cross sections for the H2+(v+ = 0-2,N+ = 1)+He proton-transfer reaction unambiguously show that the inclusion of Coriolis coupling is important in quantum dynamics scattering calculations of ion-molecule collisions.

Near-infrared collisional radiative model for Xe plasma electrostatic thrusters: the role of metastable atoms

Mestastable Xe atoms play an important role in the collisional radiative processes of dense xenon plasmas, including those of electric thrusters for space vehicles. Recent measurements and calculations of electron-excitation processes out of the 5p56s J = 2 metastable state (1s5 state in Paschen notation) have allowed for the development of a collisional radiative model for Xe near-infrared (NIR) emissions based on the population of the metastable level through 2p?1s5 radiative transitions, and based on depopulation through electron-impact excitation. A modified plasma radiative model incorporating newly computed electron-impact excitation cross sections using both relativistic distorted wave and semi-relativistic Breit?Pauli B-Spline R-matrix methods is presented. The model applies to optically thin, low-density regions of the thruster plasma and is most accurate at electron temperatures below 10?eV. The model is tested on laboratory spectral measurements of the D55 TAL and BHT-200 Hall thruster plasma NIR radiation. The metastable neutral fraction is determined to rise from 0.1 to slightly above 1% as the electron temperature increases from ~2 to 10?eV, reaching a maximum around 15?eV. Electron temperatures derived with the modified model are approximately 20% lower than a previous version of the model that used an approximate approach to account for metastable population and line intensity enhancement.

A time-dependent wave packet quantum scattering study of the reaction HD+ (v = 0 - 3;j0 = 1) + He --> HeH+(HeD+) + D(H).

Time-dependent wave packet quantum scattering (TWQS) calculations are presented for HD(+) (v = 0 - 3;j(0)=1) + He collisions in the center-of-mass collision energy (E(T)) range of 0.0-2.0 eV. The present TWQS approach accounts for Coriolis coupling and uses the ab initio potential energy surface of Palmieri et al. [Mol. Phys. 98, 1839 (2000)]. For a fixed total angular momentum J, the energy dependence of reaction probabilities exhibits quantum resonance structure. The resonances are more pronounced for low J values and for the HeH(+) + D channel than for the HeD(+) + H channel and are particularly prominent near threshold. The quantum effects are no longer discernable in the integral cross sections, which compare closely to quasiclassical trajectory calculations conducted on the same potential energy surface. The integral cross sections also compare well to recent state-selected experimental values over the same reactant and translational energy range. Classical impulsive dynamics and steric arguments can account for the significant isotope effect in favor of the deuteron transfer channel observed for HD(+)(v<3) and low translational energies. At higher reactant energies, angular momentum constraints favor the proton-transfer channel, and isotopic differences in the integral cross sections are no longer significant. The integral cross sections as well as the J dependence of partial cross sections exhibit a significant alignment effect in favor of collisions with the HD(+) rotational angular momentum vector perpendicular to the Jacobi R coordinate. This effect is most pronounced for the proton-transfer channel at low vibrational and translational energies.

Determination of photofragment ion translational energy and angular distributions in an octopole ion guide: A case study of the Ar2+ and (N2O⋅H2O)+ cluster ions

The first measurement of ion photodissociation product recoil velocity and angular anisotropy in an octopole ion guide are presented. The experimental and numerical procedures required to obtain photofragment ion translational energy and angular distributions are discussed. Cluster ions are photodissociated in an octopole ion guide, and photofragment ion velocity distributions are measured using time-of-flight (TOF). The instrumental discrimination function is determined using guiding field variation (VAR). A validation study using the 2Σg+←2Σu+ transition of Ar2+ probed at 300 nm and a photodissociation dynamics study of (N2O⋅H2O)+ to form N2OH++OH, N2O++H2O, and H2O++N2O in the 458–657 nm range are presented. The H2O+ and N2O+ photofragment translational energy and angular distributions are derived, and new information regarding the photodissociation of the (N2O⋅H2O)+ cluster ion is obtained.

Large-angle xenon ion scattering in Xe-propelled electrostatic thrusters: differential cross sections

Elastic scattering between xenon ions and xenon atoms can produce ion currents at large angles with respect to the axis of electrostatic thrusters. Differential scattering cross sections are needed to properly predict off-axis currents that can cause significant material erosion due to sputtering. Guided-ion beam differential cross section measurements are presented for Xe+ + Xe and Xe2+ + Xe elastic scattering at laboratory ion energies between 5 and 40 eV per ion charge. For the singly charged system, the experimental absolute differential cross sections are in excellent agreement with classical elastic scattering calculations based on the most recent ab initio ion–atom interaction potentials. The measurements for the doubly charged system are used to derive an approximate effective Xe2+–Xe interaction potential. The potentials are used to calculate absolute differential cross sections for both ion charge states at a typical Hall thruster ion energy of 270 eV per unit charge. The differential cross sections for the doubly charged ions are approximately a factor of 3 smaller than those of the singly charged system at large scattering angles. The importance of doubly charged ions with respect to material erosion is discussed on the basis of known sputtering yields as a function of ion energy for molybdenum and boron nitride. It is concluded that at typical charge-state ratios, doubly charged ions only have an impact at elastic scattering angles where the scattered ion energy in the laboratory (thruster) frame of reference is low and the sputtering yields depend very strongly on ion kinetic energy.

Collision-induced dissociation dynamics of Ar2+ at high levels of vibrational excitation

The collision-induced dissociation (CID) dynamics of the Ar2++Ar collision system are investigated at different Ar2+ internal energy distributions in a guided-ion beam (GIB) apparatus. The internal energy of reactant ions, assumed vibrational in a first approximation, is controlled by varying the position of ionization in a supersonic jet, electron impact ion source. Three conditions are investigated: cold, in which the ions are produced as vibrationally relaxed as possible; intermediate, in which a substantial shift in the CID onset is observed; hot, in which the apparent CID threshold is at near thermal collision energies. The vibrational distribution of the Ar2+ ions is probed at the same conditions by measuring the kinetic energy release of photofragment Ar+ following 2Σg+←2Σu+ photodissociation. The derived internal energy distributions are then used to model the observed CID cross sections with a modified line-of-centers approach to assess vibrational effects in the single-collision cross sections. ...

Molecular dynamics simulations of 1-ethyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide clusters and nanodrops.

Atomistic molecular dynamics simulations of small clusters and nanodroplets of the ionic liquid 1-ethyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide [EMIM-Tf2N] subject to an external electric field were performed. A 125-ion-pair droplet was found to be nearly spherical with an isotropic distribution of cations and anions under vacuum conditions. The droplet was subjected to external electric fields of varying strength, and ion emission events were observed. The initially spherical droplet is elongated along the electric field axis, resulting in nonspherical behavior and increased net dipole values after the application of strong electric fields. The critical electric field required for ion field emission was determined to be 0.985 V/nm, in agreement with the experimental value of 1.0 V/nm. Excellent agreement is found in the prediction of ionic emission products for a neutral 125-ion-pair droplet of the ionic liquid at an electric field strength of 1.2 V/nm when compared to the results of two independent experiments. Small ionic liquid clusters were investigated with respect to their thermal stabilities and were found to be thermally stable well above room temperature. The role of electric fields in the dissociation of small charged ion clusters was also investigated.