489 Helanshan West Rd
Xixia
Yinchuan
China
Ningxia University
Dual-metal-site catalyst, C-O bond activation, H2 dissociation, Density Functional Theory, synergistic effects
Dual-metal-site catalyst, C-O bond activation, H2 dissociation, Density functional theory, synergistic effects
Density Functional Theory, dual-functional photocatalyst, atomically precise, Pd4 cluster, monolayer MoS2
Cu−N diatomic active sites, DFT, single atom catalyst, CO2RR
Ordered mesoporous materials, High specific surface area, α-MoC, Metal doping, hydrogen evolution reaction
electrochemical CO2 reduction reaction, high-spin state driven, nitrogen-rich carbon nitride, synergistic electron injection
Selective direct deoxygenation, Single atom catalyst, High-throughput screening, Descriptors, first-principles calculations