Pseudopotentials and Basis Sets Basis Set
Topic | Replies | Views | Activity | |
---|---|---|---|---|
Specifically about Basis Set
|
![]() |
0 | 360 | October 30, 2018 |
Basis set optimization
|
![]() ![]() |
1 | 165 | January 23, 2023 |
Basis set empty orbitals
|
![]() ![]() |
2 | 171 | November 8, 2022 |
Spherical Bessel Functions
|
![]() |
0 | 143 | June 20, 2022 |
Semicore States
|
![]() ![]() ![]() |
17 | 979 | June 1, 2021 |
Basis set superposition error (BSSE) and CP correction
|
![]() ![]() |
1 | 748 | October 31, 2018 |
Energyshift and splitnorm values
|
![]() ![]() |
1 | 463 | October 31, 2018 |
Extension of the basis functions
|
![]() ![]() |
1 | 433 | October 30, 2018 |