|
Generate Relativistic pseudopotential
|
|
1
|
162
|
August 17, 2021
|
|
Error during siesta master branch installation
|
|
2
|
248
|
August 16, 2021
|
|
About OMP and MPI parallelisation
|
|
3
|
210
|
August 16, 2021
|
|
LDA pseudopotential for Carbon - good for molecules, bad for graphene?
|
|
5
|
349
|
August 5, 2021
|
|
Local projected density of state using SIESTA/TranSIESTA
|
|
6
|
237
|
July 15, 2021
|
|
HSE06 functionals in SIESTA
|
|
1
|
504
|
July 7, 2021
|
|
Cube file for non-cubic lattice
|
|
3
|
279
|
June 29, 2021
|
|
Transiesta calsulation not converging due to 'charge'
|
|
5
|
340
|
June 29, 2021
|
|
Electronic spin in Pseudopotentials (SIESTA)
|
|
2
|
280
|
June 15, 2021
|
|
DENCHAR Calculation
|
|
1
|
224
|
June 7, 2021
|
|
Electrostatic Potential visualisation
|
|
7
|
493
|
June 3, 2021
|
|
Semicore States
|
|
17
|
601
|
June 1, 2021
|
|
SIESTA School (online): "First-principles simulations of materials with SIESTA"
|
|
0
|
246
|
May 27, 2021
|
|
SIESTA utilities on Window
|
|
1
|
191
|
May 18, 2021
|
|
'Exceeded job memory limit' when using NonCollinearSpin and DM.InitSpin (Siesta)
|
|
11
|
534
|
May 10, 2021
|
|
Spin–Orbit coupling
|
|
1
|
199
|
May 5, 2021
|
|
Additional band lines in band structure
|
|
15
|
700
|
April 1, 2021
|
|
SIESTA 4.1.5 release
|
|
0
|
478
|
March 1, 2021
|
|
<< Compiling Utils using build_all script >>
|
|
1
|
299
|
February 27, 2021
|
|
How can I get emails about responses?
|
|
2
|
314
|
February 4, 2021
|
|
Kpoints read from input
|
|
3
|
300
|
February 4, 2021
|
|
Siesta: Recent developments and applications
|
|
0
|
375
|
September 21, 2020
|
|
The SIESTA method; developments and applicability
|
|
0
|
312
|
September 21, 2020
|
|
Performance Analysis of Electronic Structure Codes on HPC Systems: A Case Study of SIESTA
|
|
0
|
326
|
September 21, 2020
|
|
Basis Set - Numerical orbitals
|
|
0
|
423
|
November 14, 2018
|
|
Optical properties by siesta
|
|
2
|
884
|
August 7, 2020
|
|
How to calculate PDOS at a vacuum on top of a slab
|
|
1
|
475
|
June 19, 2020
|
|
Electronic Projected Density of States
|
|
2
|
1805
|
June 10, 2020
|
|
Calculate the BSSE correction in the van der Waals funcional
|
|
0
|
445
|
June 9, 2020
|
|
Stress tensor
|
|
5
|
630
|
June 1, 2020
|