Two-component ELF programs
The 2c-ELF programs are specifically designed for the ELF topological analysis from two-component quasirelativistic DFT calculations (SODFT) performed with a modified NWCHEM version. The programs are freely available upon request at: pilme@lct.jussieu.fr Example obtained with the 2c-ELF formalism:
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Last updated on August, 2012.