Quantum chemistry, Density Functional Theory, Stabilizer, Nitroxide radical, Fullerene C60
Molecular design, 1, 2, 4-triazole Schiff base, 3D-QSAR, Fusarium graminearum, Antifungal activity
Energy-containing metal complexes, Bis(5-nitroimino-1, 2, 4-triazole-3-yl) methane, Crystal structure, Thermal decomposition behavior, Catalytic performance
Lentinula edodes, Transcriptome, CAZYme, Secondary metabolic
Quantum chemistry, Oxadiazine, energetic material, theoretical calculation, performance prediction, molecular design
Photocatalyst, MoS2-NiS2, g-C3N4, H2 production, S-scheme heterojunction