basis-set
Topic | Replies | Views | Activity | |
---|---|---|---|---|
How to analyze the current-induced forces after transiesta calculation? | 0 | 262 | November 12, 2023 | |
Homo/Lumo in transiesta | 2 | 521 | July 4, 2023 | |
Basis set optimization | 1 | 555 | January 23, 2023 | |
Spherical Bessel Functions | 0 | 337 | June 20, 2022 | |
Basis Set - Numerical orbitals | 0 | 694 | November 14, 2018 | |
Pseudopotentials and basis sets database | 3 | 2047 | March 12, 2020 | |
Extra low basis set | 4 | 976 | March 3, 2020 | |
Extension of the basis functions | 1 | 593 | October 30, 2018 |