Jimena Gorfinkiel

Publications

• Evaluation of Recommended Cross Sections for the Simulation of Electron Tracks in Water
• Analysis of RABITT time delays using the stationary multiphoton molecular R -matrix approach
• Positron scattering from pyrazine
• Interatomic Coulombic electron capture from first principles
• Toward a description of electron-induced dissociative excitation in H2O+ : Investigation of three resonances above the B̃ state
• A Complete Cross Section Data Set for Electron Scattering by Pyridine: Modelling Electron Transport in the Energy Range 0–100 eV
• Shape and core-excited resonances in electron scattering from alanine
• Electron attachment to a proton in water by interatomic Coulombic electron capture: An R -matrix study
• Electron scattering cross section calculations for polar molecules over a broad energy range
• Electron attachment to molecular clusters
• Absolute cross sections for electronic excitation of pyrimidine by electron impact
• Recent research directions in Fribourg: nuclear dynamics in resonances revealed by 2-dimensional EEL spectra, electron collisions with ionic liquids and electronic excitation of pyrimidine
• R-matrix calculations for elastic electron and positron scattering from pyrazine: effect of the polarization description
• Methods for electron–molecule scattering
• Electron collisions with BeH2 below 20 eV
• Resonant Fragmentation of the Water Cation by Electron Impact: a Wave‐Packet Study
• Virtual photon exchange vs electron transfer in interparticle Coulombic electron capture
• Resonance effects in elastic cross sections for electron scattering on pyrimidine: Experiment and theory
• Effect of the third π ∗resonance on the angular distributions for electron-pyrimidine scattering
• The role of multichannel effects in the photoionization of the NO2 molecule: An ab initio R-matrix study
• Recent developments in R-matrix applications to molecular processes
• Effects of hydrogen bonding on pyridine resonances
• Electron scattering from molecules and molecular aggregates of biological relevance
• Cover Feature: Resonant Fragmentation of the Water Cation by Electron Impact: a Wave‐Packet Study (ChemPhysChem 19/2023)
• Resonant Fragmentation of the Water Cation by Electron Impact: a Wave‐Packet Study
• Resonances in electron scattering from H2 around the H(2l) + H−(1s2) dissociation limit
• Resonances in molecules and molecular clusters
• Atomic and molecular suite of R-matrix codes for ultrafast dynamics in strong laser fields and electron/positron scattering
• Photoionization of H2 using the molecular R-matrix with time approach
• On the computations of interatomic Coulombic decay widths with R-matrix method
• Resonances in low-energy electron scattering from para-benzoquinone
• Theoretical study of resonance formation in microhydrated molecules. I. Pyridine-(H2O)n, n = 1,2,3,5
• Theoretical study of resonance formation in microhydrated molecules. II. Thymine-(H2O)n, n = 1,2,3,5
• Shape and Core-Excited Resonances in Thiophene
• Cross sections for electron scattering from thiophene for a broad energy range
• Total electron scattering cross sections from thiophene for the (1-300 eV) impact energy range
• reskit: A toolkit to determine the poles of an S-matrix
• Quantemol Electron Collisions (QEC): An Enhanced Expert System for Performing Electron Molecule Collision Calculations Using the R-Matrix Method
• RMT: R-matrix with time-dependence. Solving the semi-relativistic, time-dependent Schrödinger equation for general, multi-electron atoms and molecules in intense, ultrashort, arbitrarily polarized laser pulses
• UKRmol+: A suite for modelling electronic processes in molecules interacting with electrons, positrons and photons using the R-matrix method
• Electron collisions with molecules and molecular clusters
• Perturbative and nonperturbative photoionization of H2 and H2O using the molecular R -matrix-with-time method
• Fano interferences in environment-enabled electron capture
• Atomic and Molecular Scattering Applications in an Apache Airavata Science Gateway
• UKRmol-scripts: a Perl-based system for the automated operation of the photoionization and electron/positron scattering suite UKRmol+
• Attosecond Chemistry Special Issue
• Resonances in electron scattering from H2 around the H(2l) + H−(1s2) dissociation limit
• Virtual photon exchange vs electron transfer in interparticle Coulombic electron capture
• Interatomic Coulombic electron capture beyond the virtual photon approximation
• Interatomic Coulombic electron capture beyond the virtual photon approximation
• Towards an accurate representation of the continuum in calculations of electron, positron and laser field interactions with molecules
• Total and partial cross sections of electron transfer processes with hydrogen gas targets: Be4+ + H2
• Ab initio potential energy surfaces and nonadiabatic couplings involved in Be4++H2 electron rearrangement
• Adapting gas-phase electron scattering R -matrix calculations to a condensed-matter environment
• Electron-impact rotational excitation of water
• Multiple scattering approach to elastic electron collisions with molecular clusters
• Resonance formation in low energy electron scattering from uracil Topical issue: Electron and Positron Induced Processes Guest editors: Michael Brunger, Radu Campeanu, Masamitsu Hoshino, Oddur Ingólfsson, Paulo Limão-Vieira, Nigel Mason, Yasuyuki Nagashima and Hajime Tanuma
• Theoretical analysis of electron capture and electron loss in Be4++H2 and H++H2 collisions
• Recent progress in electron scattering from atoms and molecules
• Low and intermediate energy electron collisions with the C-2 molecular anion
• Electron-scattering cross sections and stopping powers in H2 O
• Total and partial cross-sections of electron transfer processes with hydrogen gas targets: Be4+, B5+ + H(1s), H(2s)
• Charge transfer and dissociation in Cq+ + H2 collisions
• Ab initio molecular treatment of Be4+- H2 collisions
• Novel model potential treatment of charge transfer cross sections in C4+ and N5+ collisions with H2
• Elastic and inelastic cross sections for low-energy electron collisions with pyrimidine
• Shape and core excited resonances in electron collisions with diazines
• Energy deposition model based on electron scattering cross section data from water molecules
• Electron impact ionization of small molecules at intermediate energies: The molecular R-matrix with pseudostates method
• Low-energy electron collisions with water: Elastic and rotationally inelastic scattering
• Electron scattering cross sections and stopping powers in H2
• Low-energy electron collisions with methanol
• Implementation of the sudden approximation eikonal method in ion-diatom collisions
• Low-energy electron collisions with tetrahydrofuran
• Electron attachment to molecules in a cluster environment
• UKRmol: A low-energy electron-and positron-molecule scattering suite
• Electron-H3+ collisions at intermediate energies
• Model potential treatment of C4+ + H2 collisions at low impact energies
• Molecular calculation of charge transfer cross sections in C4++H collisions
• Electron impact dissociative excitation of water within the adiabatic nuclei approximation
• Electron scattering from pyridine
• Multiple scattering approach to elastic low-energy electron collisions with the water dimer
• Low-energy electron collisions with pyrazine
• Elastic and inelastic low-energy electron collisions with pyrazine
• Low-energy electron collisions with C2 using the R-matrix method
• A joint theoretical and experimental study for elastic electron scattering from 1,4-dioxane
• Cross-section calculations for positron scattering from pyrimidine over an energy range from 0.1 to 10000 eV
• Ab initio calculation of charge transfer cross sections in C4++H2 collisions
• Electron molecule collisions calculations using the R-matrix method
• An investigation into electron scattering from pyrazine at intermediate and high energies
• Electron-molecule collisions at low and intermediate energies using the R-matrix method
• GTOBAS: Fitting continuum functions with Gaussian-type orbitals
• Ab initio study of collisions between Li+ or H+ ions and H2 (D2, DT, T2) molecules
• A multiple-scattering approach to electron collisions with small molecular clusters
• Fragmentation dynamics through geometrical distortion in low-energy electron attachment to carbon disulfide