Rettie, AJE;
              
      
            
                Ding, J;
              
      
            
                Zhou, X;
              
      
            
                Johnson, MJ;
              
      
            
                Malliakas, CD;
              
      
            
                Osti, NC;
              
      
            
                Chung, DY;
              
      
            
            
          
      
            
            
          
      
            
            
          
      
            
            
            ... Kanatzidis, MG; + view all
            
          
      
        
        
        
    
  
(2021)
  A two-dimensional type I superionic conductor.
Nature Materials
, 20
      
    
     pp. 1683-1688.
    
         10.1038/s41563-021-01053-9.
  
  
       
    
  
| Preview | Text Rettie_MS_KAg3Se2_QENS_ReSub_Clean_v1.pdf - Accepted Version Download (1MB) | Preview | 
Abstract
Superionic conductors possess liquid-like ionic diffusivity in the solid state, finding wide applicability from electrolytes in energy storage to materials for thermoelectric energy conversion. Type I superionic conductors (for example, AgI, Ag2Se and so on) are defined by a first-order transition to the superionic state and have so far been found exclusively in three-dimensional crystal structures. Here, we reveal a two-dimensional type I superionic conductor, α-KAg3Se2, by scattering techniques and complementary simulations. Quasi-elastic neutron scattering and ab initio molecular dynamics simulations confirm that the superionic Ag+ ions are confined to subnanometre sheets, with the simulated local structure validated by experimental X-ray powder pair-distribution-function analysis. Finally, we demonstrate that the phase transition temperature can be controlled by chemical substitution of the alkali metal ions that compose the immobile charge-balancing layers. Our work thus extends the known classes of superionic conductors and will facilitate the design of new materials with tailored ionic conductivities and phase transitions.
| Type: | Article | 
|---|---|
| Title: | A two-dimensional type I superionic conductor | 
| Open access status: | An open access version is available from UCL Discovery | 
| DOI: | 10.1038/s41563-021-01053-9 | 
| Publisher version: | https://doi.org/10.1038/s41563-021-01053-9 | 
| Language: | English | 
| Additional information: | This version is the author accepted manuscript. For information on re-use, please refer to the publisher’s terms and conditions. | 
| Keywords: | Atomistic models, Phase transitions and critical phenomena, Solid-state chemistry, Structure of solids and liquids | 
| UCL classification: | UCL UCL > Provost and Vice Provost Offices > UCL BEAMS UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Engineering Science UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Engineering Science > Dept of Chemical Engineering | 
| URI: | https://discovery.ucl.ac.uk/id/eprint/10133249 | 
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