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      10/10/2022
    Numerical stability and efficiency of response property calculations in density functional theory
Response calculations in density functional theory aim at computing the ...
          
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      09/03/2020
    Black-box inhomogeneous preconditioning for self-consistent field iterations in density functional theory
We propose a new preconditioner for computing the self-consistent proble...
          
            research
          
      
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      04/28/2020