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Published in 2019 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-019-4109-1
Abstract: The suitability of P-doped g-C3N4 for sodium storage was assessed using density functional theory. The electronic structure of P-doped g-C3N4 was calculated and the results indicate that the presence of the P atom causes the…
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Keywords:
exploring effect;
doping utility;
c3n4;
effect phosphorus ... See more keywords