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the_density_functional_program [2024/12/16 20:31] – [LibXC functionals] hesselmannthe_density_functional_program [2025/01/09 09:54] (current) – fix layout doll
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 The total energy will then be calculated as EDFT-D2=EDFT+Edisp(D2) if x=d2 (see Ref. [2]), The total energy will then be calculated as EDFT-D2=EDFT+Edisp(D2) if x=d2 (see Ref. [2]),
-EDFT-D3=EDFT+Edisp(D3) if x=d3 (see Ref. [3]), and EDFT-D4=EDFT+Edisp(D4) if x=d4 (see Ref. [4]).+EDFT-D3=EDFT+Edisp(D3) if x=d3 (see Ref. [3]), and 
 +EDFT-D4=EDFT+Edisp(D4) if x=d4 (see Ref. [4]).
  
 Currently the default dispersion correction added to the DFT energy is the D4 dispersion correction developed by Grimme //et al.//, see Ref. [4].  Currently the default dispersion correction added to the DFT energy is the D4 dispersion correction developed by Grimme //et al.//, see Ref. [4].