Studying the micromechanism of water injection to suppress coal and gas protrusion
To explore the adsorption mechanism of CH4 and H2O molecules on the surface of low-rank coal (LRC) from the microscopic point of view, the electrostatic potential and frontier orbitals of each oxygen-containing functional group (OFGs) in LRC and adsorbent molecule, the adsorption energy, and Mullike...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2022-12-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/5.0130863 |