Phase Transition of MnN<sub>2</sub> Associated with N<sub>2</sub> Dimer Alignment under High Pressure and High Temperature

Manganese pernitride (MnN<sub>2</sub>) was synthesized at a pressure of approximately 60 GPa and a temperature of approximately 2000 K for the first time. A phase transition between rhombohedral and triclinic symmetry associated with the alignment of the N<sub>2</sub> dimer was also clearly observed at high temperatures under high pressure or along the decompression process at room temperature. The present experimental results with DFT calculations offer new insights and diversity into the crystal chemistry of the transition metal pernitrides concerning temperature and pressure.

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Publication Details

Journal
Inorganic Chemistry
Published
2025-05-23
DOI
https://doi.org/10.1021/acs.inorgchem.5c01118
Primary Topic
Boron and Carbon Nanomaterials Research
Type
article
Field-Weighted Citation Impact
0.00

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Phase Transition of MnN2 Associated with N2 Dimer Alignment under High Pressure and High Temperature

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Phase Transition of MnN2 Associated with N2 Dimer Alignment under High Pressure and High Temperature

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article en

Abstract

Manganese pernitride (MnN<sub>2</sub>) was synthesized at a pressure of approximately 60 GPa and a temperature of approximately 2000 K for the first time. A phase transition between rhombohedral and triclinic symmetry associated with the alignment of the N<sub>2</sub> dimer was also clearly observed at high temperatures under high pressure or along the decompression process at room temperature. The present experimental results with DFT calculations offer new insights and diversity into the crystal chemistry of the transition metal pernitrides concerning temperature and pressure.

Inorganic ChemistryVol. 64(22)
Japan Synchrotron Radiation Research Institute (JP), Nagoya University (JP)
Japan Society for the Promotion of Science, Fusion Oriented REsearch for disruptive Science and Technology
Climate action
Openalex Percentile: Top 92%
Boron and Carbon Nanomaterials Research
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