Código QR (código de barras bidimensional)

Ab Initio Rovibrational Spectroscopy of the Acetylide Anion

In this work the rovibrational spectrum of the acetylide anion HCC<inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics><msup><mrow></mrow><mo>−</mo></msup></semantics></math></inline-formula> is investigated using high-level electronic structure methods and va...

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Hovedforfatter: Benjamin Schröder
Format: Artigo
Sprog:Inglês
Udgivet: MDPI AG 2023-07-01
Serier:Molecules
Fag:
acetylide anion
potential energy surface
variational calculations
rovibrational spectrum
spectroscopic parameters
Online adgang:https://www.mdpi.com/1420-3049/28/15/5700
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