TY - GEN AU - Wang,Baojun AU - Wang,Liping AU - Zhang,Riguang AU - Ling,Lixia TI - The role of CS₂ in CS₂/NMP mixed solvent in weakening the hydrogen bond of OH-N in coal: a DFT investigation SN - 0948-5023 PY - 2012///0807 KW - Carbon Disulfide KW - chemistry KW - Coal KW - Hydrogen Bonding KW - Models, Molecular KW - Pyrrolidinones KW - Solvents N1 - Publication Type: Journal Article; Research Support, Non-U.S. Gov't UR - https://doi.org/10.1007/s00894-011-1128-y ER -