Pseudopotentials and Basis Sets Basis Set
Topic | Replies | Views | Activity | |
---|---|---|---|---|
Specifically about Basis Set
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0 | 493 | October 30, 2018 | |
Basis set optimization
|
1 | 485 | January 23, 2023 | |
Basis set empty orbitals
|
2 | 344 | November 8, 2022 | |
Spherical Bessel Functions
|
0 | 290 | June 20, 2022 | |
Semicore States
|
17 | 1974 | June 1, 2021 | |
Basis set superposition error (BSSE) and CP correction
|
1 | 918 | October 31, 2018 | |
Energyshift and splitnorm values
|
1 | 628 | October 31, 2018 | |
Extension of the basis functions
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1 | 560 | October 30, 2018 |