Probable interstellar MgX- (X = CN, NC, CCH, CC, C3N, NCCC, CCNC, C4H, and C4): A DFT study

Astronomy and Astrophysics – Astronomy

Scientific paper

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Scientific paper

The geometries, dipole moments, and rotational constants for several
magnesium compounds and their anions were calculated by using the
B3LYP/Aug-cc-pVTZ method. The rotational constants of linear forms have
been derived to be used for laboratory experiment and astronomical
observation.

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