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Quantemol-DB: Reaction Process List

Reaction Processes identified in QDB.

Abbreviation Description Example
EDX deexcitation e- + A* → e- + A
EEL elastic scattering e- + A → e- + A
EIN ionization e- + A → e- + A+ + e-
EMT momentum transfer
ERR radiative recombination e- + A+ → A + hν
EDR dissociative recombination e- + AB+ → A + B
EDS dissociation e- + AB → e- + A + B
EDA dissociative attachment e- + AB → A + B-
EDE dissociative excitation e- + AB → A* + B + e-
EDI dissociative ionization AB + e- → A+ + B + 2e-
PDS photodissociation AB + hν → A + B
PEX photoexcitation A + hν → A*
XHAD association and electron detachment A- + B → AB + e-
HCX charge transfer A+ + B → A + B+
EXE Electron impact electronic excitation e- + A → e- + A*
HIR heavy-particle interchange A + BC → AB + C
EED change of excitation e- + A* → e- + A**
ERC recombination (general) A+z + e- → A+(z-1)
HAC association A + B → AB
HIN heavy particle collisional ionization A + B → A + B+ + e-
XHIA heavy particle association and ionization A + B → AB+ + e-
ZZZ unset [default unset process type]
HPN Penning ionization A + B* → A+ + B + e
XENE neutralization e + B- → B + 2e
ENI electron attachment A + B + e→ A + B-
HMN ions recombination A-+ B+ → A + B
HDS heavy particle collisional dissociation AB + C → A + B + C
HDX heavy particle collisional deexcitation A + B* → A + B
HDN heavy particle dissociative neutralization AB- + C+ → A + B + C
HDC heavy particle dissociation and charge transfer AB + C+ → A+ + B + C
HDI heavy particle dissociation and ionization AB + C* → A+ + B + C + e-
PRD Radiative Decay A* → A + hν
EXV electron impact vibrational excitation e- + A → e- + A[v=*]
ETS electron total scattering e- + A → e- + Σ{A}
XETI electron total ionisation e- + A → e- + e- + Σ{A+}
XETA electron total attachment e- + A → Σ{A-}
XETD electron total dissociation e- + A → e- + Σ{A}
XETN electron total neutral dissociation e- + A → e- + Σ{A}
HEX heavy particle excitation A + B → A + B*
HDT heavy particle electron detachment A- + B → A + B + e-
MAD Polymer Adsorption A + S → P(ads; S)
MDE Polymer Desorption P(ads; S) → A + S
XMPS Neutral passivation
MCS Ion Chemical Sputtering
EXR electron rotational excitation
EIP Ion Pair Creation
XHFR heavy particle fragmentation AB → A + B
HES heavy particle elastic scattering A + B → A + B
HAR radiative association A + B → AB + hν
XHTR Electron Transfer A- + B → A + B-
EAE Auger Electron Ejection e- + A → A**+ + 2e-; A**+ → A*2+ + e-
EAS Angular Scattering
EBS Bremsstrahlung e- + A → e- + A + hν
EDC Dielectronic Capture e- + A+ → A**
EDP Depolarization, Change of Polarization
EDT Electron Detachment e- + A- → A + 2e-
EEX Excitation e- + A → e- + A*
EFL Fluorescence (Optical Emission)
EGN General
EHT Transport
ELB Line Broadening, Shapes and Shifts
EMI Multiple Ionization e- + A → An+ + (n+1)e-
ERD Dielectronic Recombination e- + A+ → A** → A* + hν
ERO Electron-Ion-Other Recombination e- + A+ + B → A + B
ERT Three-Body Recombination e- + e- + A+ → A + e-
ERV Rovibrational Excitation e- + AB → e- + AB (v=*; J=*)
ESF Spin-Flip e- + [S]A → e- + [S']A
HAI Associative Ionization A + B → AB+ + e-
HAS Angular Scattering
HAT Attenuation
HDE Dissociative Excitation A + BC → A* + B + C; A + BC → A + B + C*
HEL Inelastic Energy Losses
HET Energy Transfer
HFL Fluorescence A + B → A* + B; A* → A + hν
HGN General
HHT Transport
HIP Interaction Potentials
HLB Line Broadening, Shapes and Shifts
HMI Multiple Ionization A + B → An+ + (n+1)e- + B
HMT Momentum Transfer
HRC Recombination
HRV Rovibrational Excitation A + BC → A + BC (v=*; J=*)
HST Electron-Stripping A + B → A+ + B + e-
HTE Electron Transfer A- + B → A + B-
HTI Transfer Ionization A + B+ → A2+ + B + e-
HTS Total Scattering
HXE Electronic Excitation A + BC → A + BC*
HXF Fine-Level Excitation A + B → A + B (J=*)
HXH Hyperfine Excitation e- + AB → e- + AB (F=*)
HXR Rotational Excitation A + BC → A + BC (J=*)
HXT Excitation Transfer A* + B → A + B*
HXV Vibrational Excitation A + BC → A + BC (v=*)
MAC Accomodation
MBS Backscattering
MCP Charge State Population
MCR Chemical Reactions
MDF Diffusion
MDP Deposition
MEL Energy Loss and Stopping Power
MEP Excited State Population
MER Erosion
MGN General
MIR Particle-Impact Induced Radiation
MMS Multiple Scattering
MNE Neutralization, Ionization, Dissociation
MPE Photoelectric Ejection of Electrons
MPM Permeation
MPR Particle Range
MPS Physical Sputtering
MRC Recombination
MRE Reemission
MRF Reflection
MRH Reflection of Heavy Particles from Surfaces
MRL Reflection of Electrons from Surfaces
MRS Radiation-Enhanced Sublimation
MSD Surface Damage
MSE Secondary Electron Emission
MSI Surface Interactions
MSL Solubility
MSP Sputtering
MTD Trapping, Detrapping
MTR Transmutation
MVP Vapour Formation and Properties
PAD Scattering
PAE Auger Electron Ejection A + hν → A**+ + e-; A**+ → A*2+ + e-
PCS Compton Scattering
PDP Depolarization, Change of Polarization
PDT Photodetachment hν + A- → A + e-
PEA Effective Absorption, Total Diffusion
PED Elastic Diffusion
PES Elastic Scattering hν + A → hν + A
PFF Inverse Bremsstrahlung e- + A + hν → A + e-
PFL Fluorescence A* → A + hν
PGF General Electromagnetic Field
PGN General
PIN Photoionization hν + A → A+ + e-
PIP Ion-Pair Formation AB + hν → A+ + B-
PMA Multiphoton Excitation nhν + A → A+/A*/A*+
PNL Non-Linear Effects
PRV Rovibrational Excitation BC + hν → BC (v=*; J=*)
PSE Stark Effect
PTA True Absorption
PTF Interaction with Time-Varying Fields
PTS Total Absorption, Total Scattering
PXE Electronic Excitation BC + hν → BC*
PXR Rotational Excitation BC + hν → BC (J=*)
PXV Vibrational Excitation BC + hν → BC (v=*)
PZE Zeeman Effect
SAD Autodetachment
SAI Autoionization
SDP Dynamic Polarizability
SDS Autodissociation
SEW Energy Levels and Wavelengths
SFT Forbidden Transitions
SGN General
SHF Hyperfine Structure
SIA Interatomic Potentials
SIE Isoelectronic sequences
SIP Ionization Potentials
SIR Infrared Spectra
SLS Line Broadening, Shapes and Shifts
SLT Lifetimes
SMM Magnetic Moments
SPM Polarizabilities, Electric Moments
SQE QED Effects
SRA Raman spectroscopy
SRP Relaxation Processes
SRS Rotational Spectra
SRY Rydberg States
SSM Potential Curves and Structure of Molecules
STP Transition Probabilities and Oscillator Strengths
SUV UV/VUV/XUV Spectra
SVB Vibrational Spectra
SVS Visible Spectra
SXR X-Ray Spectra