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Keyword [DFT theoretical calculation]
Result: 1 - 20 | Page: 1 of 2
1. Solid-State NMR Studies On The Reaction Mechanism Of Hetcrogeneous Catalysis And On The Polymorphy Of Pharmacetical Compounds
2. Calculation Of ~1H NMR Of Pentanediol Aromatic Diester And The Mechanism Research Of Propene Bromination
3. The Exploitation And Investigation Of Efficient Catalysts For The Preparation Of Ethylene Glycol Via Ethylene Oxide Hydration
4. The Application Of Etched Ti3AlC2-Based Materials In The Sorption Of Environmental Pollutants
5. Study On The Oxygenation Of The Cobalt Alaninend And The Application In Oxidative Degradation Of Lignin
6. Study On Syntheses,Crystal Structures And Properties Of Salamo-Like Transition Metal (Ⅱ) Complexes And Dual Channel Chemical Sensors
7. Experimental Observations And Theoretical Simulation Of Noncentrosymmetric(NCS) Two-dimensional System
8. Investigations On Palladium Catalyst Systems And Reaction Mechanism For Four-membered-ring-strain Drived Ring-opening And Ring Expansion Transformations
9. Theoretical Research Of Cu/ZnO/Al2O3 Catalyst For Methanol Production From CO2
10. Study On Doping Modification And Adsorption Performance Of Manganese-based Lithium Ion Adsorbent
11. Study On The Adsorption Behavior And Mechanism Of Small Hydroxyl-containing Molecules On Non-polar ZnO(11(?)0) Surface
12. The Efficient Preparation And Optical Properties Of Copper-based And Silver-based Metal Halides
13. Construction Of Lattice-oxygen-vacancy-rich FeCo2O4 QDS/β-FeOOH Nanocomposites And Their Efficacy And Mechanism For Activating PMS To Degrade Metronidazole In Water
14. Effect Of Doping Elements On The Electrocatalytic Ammonia Synthesis Performance Of MnO2
15. Theoretical Design Of Layered Double Hydroxides And The Performance For Arsenic Removal
16. Study On Performance And Reaction Mechanism Of Photocatalytic Direct Dehydrogenation Of Methanol By Catalyst Based On Titanium Dioxide
17. Study On Efficiency And Mechanism Of Oxalic Acid And Ethanol Co-reduction Of Cr(Ⅵ) And Simulation Of In Situ Remediation Of Cr(Ⅵ) Contaminated Groundwater
18. Application Of LDH Materials In Electrochemical Ammonia Synthesis
19. Preparation And Electrochemical Performance Of Nickel Cobalt Based Hydroxide Composites
20. Preparation Of Multifunctional Polyol Ester-based Rare Earth Metal Alkols And Their Application As Additives For PVC
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