exciting

Topic	Replies	Views	Activity
Oxygen Updates exciting Oyxgen is patched as and when we find problems. For the latest bug fixes and improvements, please pull from our Github page. Changes are documented in the CHANGELOG.md and the git log.	1	510	February 14, 2022
Linearisation energy not found	0	8	May 17, 2024
Gks framework and noncollinear spin spiral calculation	0	16	May 16, 2024
Regarding parallelization of exciting code calculation	4	55	May 13, 2024
Could we modify the exciting Species Files?	2	125	May 12, 2024
Converging K points in XANES-BSE calculations	2	123	May 12, 2024
Density of states calculation gives me density of states equal to 0?	1	131	May 12, 2024
TLDR: Energy loss function, work function, and ionic liquids on exciting?	1	82	May 12, 2024
Possible bug in Spin-Texture Calculation	0	99	February 25, 2024
Second Harmonic Generation: components of the SHG susceptibility tensor that are expected to be zero howto	0	101	January 5, 2024
Degenerate local-orbital radial functions	0	141	January 3, 2024
How to convert a CIF file to Exciting's input.xml rapidly? howto	5	545	December 21, 2023
Can we set different rgkmax & gmaxvr values for different elements in a single task?	0	93	December 7, 2023
Issue at the moment of compiling exciting.fluorine	3	282	December 5, 2023
Installation error - outdated LAPACK version error	0	92	November 30, 2023
Error in installing exciting using either gfortran or ifort	2	121	November 24, 2023
Hybrid Functionals	0	184	October 4, 2023
Compilation of Exciting Fluorine(/Oxygen) with HDF5 howto	5	399	September 6, 2023
SCF Fails to start for MoO3	2	270	September 5, 2023
Molecular structure optimization convergence failed	0	198	July 12, 2023
Query about PLOT-phonon-anim.py	0	192	July 8, 2023
Large deformation with Exciting code	1	239	June 28, 2023
Time-evolution Bethe-Salpeter equation	1	266	June 21, 2023
Sgroup execution	0	227	June 3, 2023
Compilation of the Exciting code	3	372	April 22, 2023
Error while compiling exciting_oxygen on Ubantu platform	1	382	March 31, 2023
Element.xml in case of SOC	1	237	February 15, 2023
Van der Waals structure optimization in exciting howto	1	327	February 13, 2023
Exciting - sgroup on volume optimization	21	1145	February 2, 2023
Compilation error exciting_oxygen on Ubuntu	7	1018	January 21, 2023

Oxygen Updates

exciting Oyxgen is patched as and when we find problems. For the latest bug fixes and improvements, please pull from our Github page. Changes are documented in the CHANGELOG.md and the git log.