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Related Concept Videos

UV–Vis Spectroscopy: Molecular Electronic Transitions01:16

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In Ultraviolet–Visible (UV–Vis) spectroscopy, the absorption of electromagnetic radiation is used to probe the electronic structure of molecules. This technique provides insights into molecular electronic transitions, particularly the movement of electrons between different molecular orbitals. Radiation is absorbed if the energy of the electromagnetic radiation passing through the molecule is precisely equal to the energy difference between the excited and ground states. During this...
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Atomic Absorption Spectroscopy: Overview01:27

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Atomic absorption spectroscopy (AAS) is a technique used to analyze elements by measuring electromagnetic radiation (EMR) absorbed by atoms, which causes them to transition to a higher-energy orbit. The most crucial step in AAS is atomization, where the analyte is converted into gas-phase atoms, typically through a flame or furnace. Some of these atoms become thermally excited in the flame, while most remain in the ground state.
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Molecular Spectroscopy: Absorption and Emission01:14

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Molecules possess discrete energy levels called quantum states. Unlike atoms, which have simpler energy levels, molecules possess additional rotational and vibrational energy levels.  Each energy level is separated by an energy gap, with the gaps between adjacent electronic, vibrational, and rotational levels varying significantly. The three types of energy levels in a diatomic molecule are shown in Figure 1.
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Atomic Absorption Spectroscopy: Instrumentation01:22

Atomic Absorption Spectroscopy: Instrumentation

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An atomic absorption spectrophotometer (AAS) comprises several components: a radiation source, an atomizer, a monochromator, and a detector. The radiation source can be a hollow-cathode lamp (HCL) or an electrodeless-discharge lamp (EDL), both of which provide a narrow emission line of the required wavelength. However, some instruments use continuum sources and high-resolution monochromators to achieve a narrow range of radiation.
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Atomic Emission Spectroscopy: Instrumentation01:22

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The instrumentation of atomic emission spectrometry (AES) involves various components, including atomization devices that convert samples into gas-phase atoms and ions. There are two main types of atomization devices: continuous and discrete atomizers.  Continuous atomizers, like plasmas and flames, introduce samples in a constant stream, while discrete atomizers inject individual samples using syringes or autosamplers. The most common discrete atomizer is the electrothermal atomizer.
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Atomic Absorption Spectroscopy: Lab01:21

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For AAS measurements, samples must be introduced as clear solutions, often requiring extensive preliminary treatment to dissolve materials like soils, animal tissues, and minerals. Common methods for sample preparation include treatment with hot mineral acids, wet ashing, combustion in closed containers, high-temperature ashing, or fusion with reagents.
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Updated: Nov 21, 2025

Measurement and Analysis of Atomic Hydrogen and Diatomic Molecular AlO, C2, CN, and TiO Spectra Following Laser-induced Optical Breakdown
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The diatomic molecular spectroscopy database.

Xiangyue Liu1, Stefan Truppe1, Gerard Meijer1

  • 1Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, 14195, Berlin, Germany.

Journal of Cheminformatics
|January 12, 2021
PubMed
Summary
This summary is machine-generated.

A new website offers easy access to spectroscopic constants and Franck-Condon factors for diatomic molecules. This open-access database supports research in astrochemistry, combustion, and ultracold physics.

Keywords:
Franck–Condon factorsLaser coolingMolecular spectroscopic constantsOpen database

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Area of Science:

  • Chemical Physics
  • Spectroscopy
  • Computational Chemistry

Background:

  • Diatomic molecule spectroscopy is vital for astrochemistry, combustion, and ultracold physics.
  • Existing resources lack easily accessible databases for spectroscopic constants and Franck-Condon factors.
  • Franck-Condon factors are crucial for assessing laser cooling potential in molecules.

Purpose of the Study:

  • To develop a user-friendly, open-access website for retrieving diatomic molecule spectroscopic data.
  • To provide spectroscopic constants and vibrational Franck-Condon factors in accessible formats.
  • To facilitate data sharing and collaboration within the chemical physics community.

Main Methods:

  • Developed a website utilizing the LAMP stack (Linux, Apache, MySQL, PHP).
  • Data includes spectroscopic constants for ground and first excited states.
  • Website allows user registration and data uploads, licensed under Apache License 2.0.

Main Results:

  • A functional, data-driven website is now available at https://rios.mp.fhi.mpg.de.
  • Spectroscopic constants and Franck-Condon factors are retrievable in user-friendly formats.
  • The platform supports open access and collaborative maintenance of molecular spectroscopic data.

Conclusions:

  • The developed website provides essential diatomic molecule spectroscopic information efficiently.
  • This resource aids the chemical physics community in identifying molecules for spectroscopic investigation.
  • Promotes open data principles and collaborative research in molecular spectroscopy.