| 1 |
The critical role of hydride (H-) ligands in electrocatalytic CO2 reduction to HCOOH by [Cu25H22(PH3)(12)]Cl nanocluster
Li FH, Tang Q
Journal of Catalysis, 387, 95, 2020 |
| 2 |
Identification of molecular vibrations associated with tacticity in polypropylene: Density functional theory-based simulations
Mitra N, Prasad D, Banerjee S
Journal of Polymer Science Part B: Polymer Physics, 57(20), 1378, 2019 |
| 3 |
Theoretical investigation of selective hydrogenation of 1,3-butadiene on Pt doping Cu nanoparticles
Liu D, Chen HY, Zhang JY, Huang JY, Li YM, Peng QM
Applied Surface Science, 456, 59, 2018 |
| 4 |
Point defects in MoS2: Comparison between first-principles simulations and electron spin resonance experiments
Houssa M, Iordanidou K, Pourtois G, Afanas'ev VV, Stesmans A
Applied Surface Science, 416, 853, 2017 |
| 5 |
DFT study of hydrogen production from formic acid decomposition on Pd-Au alloy nanoclusters
Liu D, Gao ZY, Wang XC, Zeng J, Li YM
Applied Surface Science, 426, 194, 2017 |
| 6 |
Hydroxamic acid interactions with solvated cerium hydroxides in the flotation of monazite and bastnasite-Experiments and DFT study
Sarvaramini A, Azizi D, Larachi F
Applied Surface Science, 387, 986, 2016 |
| 7 |
Quaternary Diamond-Like Chalcogenidometalate Networks as Efficient Anode Material in Lithium-Ion Batteries
Kaib T, Haddadpour S, Andersen HF, Mayrhofer L, Jarvi TT, Moseler M, Moller KC, Dehnen S
Advanced Functional Materials, 23(46), 5693, 2013 |
