Topics tagged basis-set

Topic	Replies	Views	Activity
Homo/Lumo in transiesta TranSIESTA band-structure , electrodes , hamiltonian , pdos , basis-set	1	161	February 26, 2023
Basis set optimization Basis Set k-points , basis-set	1	165	January 23, 2023
Spherical Bessel Functions Basis Set basis-set	0	143	June 20, 2022
Basis Set - Numerical orbitals SIESTA Publications basis-set	0	520	November 14, 2018
Pseudopotentials and basis sets database Pseudopotentials and Basis Sets basis-set , pseudo	3	1255	March 12, 2020
Extra low basis set Pseudopotentials and Basis Sets basis-set	4	726	March 3, 2020
Extension of the basis functions Basis Set basis-set	1	433	October 30, 2018