Latest Ground state topics

Topic	Replies	Views	Activity
Moderators : Bogdan Guster @bguster, Alireza Sasani and Joe Zwanziger @jzwanzig For information, the moderators of this category are Bogdan Guster @bguster, Alireza Sasani and Joe Zwanziger @jzwanzig	1	305	July 10, 2021
About the Ground state category	0	372	January 10, 2021
WS mesh error message	1	16	August 28, 2025
Perform phonon calculations	4	45	July 22, 2025
Incorrect space group symmetry of impure TiO2 lattice	2	52	June 19, 2025
Constrained DFT - Difficulty Finding Fermi Energy testing	1	36	June 19, 2025
Dos calculation	6	100	June 9, 2025
Efficiency of calculating large supercells	4	95	May 21, 2025
Band structure calculation using SOC testing	3	66	May 6, 2025
Number of electron in the valence band	2	29	April 29, 2025
Input file for TB-mBJ correction	1	29	April 29, 2025
Comparison between collinear and non-collinear ferromagnetic magnetization using constrained	5	75	April 10, 2025
Understanding Memory Estimates in Output Files	0	28	April 9, 2025
Problem with calculating and printing orbital moment	3	39	April 7, 2025
Error message: Found token: `YPAT` in the input file	2	39	March 12, 2025
Is there a way to split dense k-grid calculations? parallelism	1	39	February 12, 2025
How to calculate Nonlinear Static Properties without multidataset mode as suggested in the tutorial and How to use parallelization for Nonlinear Optical Property Calculation parallelism	4	28	January 31, 2025
Siliciumdioxide - No convergence	6	57	January 22, 2025
Flexoelectric coefficients of Strontium Titanante	3	49	January 16, 2025
Trouble achieving GS convergence with tolvrs	1	48	January 14, 2025
Pseudopotential	2	70	January 4, 2025
Customized fatbands_mview	0	26	December 6, 2024
Total magnetization goes to saturation value for a small spinat	2	36	November 22, 2024
Segmentation fault while writing WFK of a band structure calculation	2	57	November 20, 2024
Customize plot using abipy	3	40	November 15, 2024
Electron hole pair	0	25	November 15, 2024
Density of States of Graphene - Unitcell vs Supercell	3	164	November 13, 2024
Deviations in the optimized lattice constants of TiO2 supercells	0	77	November 9, 2024
Question About Superlattice Simulation AlGaN	4	109	November 8, 2024
Question about m-resolved fatbands	1	33	November 7, 2024