issues
search
mstsuite
/
MuST
Multiple Scattering Theory code for first principles calculations
BSD 3-Clause "New" or "Revised" License
55
stars
30
forks
source link
issues
Newest
Newest
Most commented
Recently updated
Oldest
Least commented
Least recently updated
Installation issue
#65
DFTsher
opened
4 months ago
10
Inquiry on Implementation of Liechtenstein Formula
#64
KylinGuo
opened
4 months ago
1
Changed MaxComponents values to 20
#63
vishnu2709
closed
4 months ago
0
Updating Chatterjee method for average eta
#62
beepbeepace
closed
7 months ago
0
Change Docker image to Singularity image modified: README.md
#61
liangstein
closed
9 months ago
0
changes in kubo.F90 and cusolver_LSMS_c.cu
#60
liangstein
closed
9 months ago
0
Installation Issue in MACOS
#59
pshatom
opened
10 months ago
3
workshop2023-flyer
#58
terletska
opened
11 months ago
1
slides 2023
#57
terletska
opened
11 months ago
0
pic2023
#56
terletska
opened
11 months ago
0
LSMS Conductivity (Serial) + Fix for Zero-Point Energy in o file + Sine matrix zeros
#55
vishnu2709
closed
1 year ago
0
GG syntax for batch scripting purposes, to make output clearer
#54
beepbeepace
closed
1 year ago
0
Update README.md
#53
liangstein
closed
1 year ago
0
Update data reading functions and plotting
#52
yuqing-lin
closed
1 year ago
0
Update README_fitting.md
#51
yuqing-lin
closed
1 year ago
0
Update README_fitting.md
#50
yuqing-lin
closed
1 year ago
0
Update README_fitting.md
#49
yuqing-lin
closed
1 year ago
0
Add morse_bm_fitting utility code and README_fitting
#48
yuqing-lin
closed
1 year ago
0
Update README
#47
yuqing-lin
closed
1 year ago
0
KKR calculations fail
#46
cwhaddon
closed
1 year ago
9
Updating ChemElementModule.F90 with Atomic Masses and Debye Temps
#45
beepbeepace
closed
1 year ago
0
GPU KKR
#44
liangstein
closed
1 year ago
0
Help with CPA: Setup and Convergence
#43
spattamatta
opened
1 year ago
1
Adding missing files to Potentials
#42
beepbeepace
closed
1 year ago
0
Updated Naming Conventions in Potentials Directory
#41
beepbeepace
closed
1 year ago
0
GPU acceleration of KKR, and update architecture files
#40
liangstein
closed
1 year ago
0
added architecture files for nvhpc compilers
#39
liangstein
closed
1 year ago
0
fix memory error with variable tau00 in cusolver_invwhole_c_
#38
lyuwen
closed
1 year ago
0
pic
#37
terletska
opened
1 year ago
0
Added a GPU demo for the u56 test case
#36
liangstein
closed
1 year ago
0
Add the CPU architecture file for Bridges2, and fix a endif error
#35
liangstein
closed
1 year ago
0
add new architecture file for several GPU systems and add GPU/CPU switch
#34
liangstein
closed
1 year ago
0
GPU Acceleration
#33
liangstein
closed
1 year ago
0
Add docker container of MST
#32
pmu2022
closed
1 year ago
0
About scf error: rho0(ir) < 0
#31
hitliaomq
closed
1 year ago
2
Can MuST handle structures more than cubic
#30
hitliaomq
closed
1 year ago
2
How to generate new potential
#29
hitliaomq
closed
1 year ago
2
Error occured during mst2 run: forrtl: severe (174): SIGSEGV, segmentation fault occurred
#28
KylinGuo
closed
1 year ago
11
Fixes issues with cmake
#27
pmu2022
closed
1 year ago
0
fig
#26
terletska
closed
2 years ago
0
fix cmake build
#25
pmu2022
closed
2 years ago
0
CMake Build System
#24
imanjehanzeb1
closed
2 years ago
0
Commented out checkinTiming line from SSSolverModule
#23
vishnu2709
closed
2 years ago
0
Added KUBO tutorial files and removed factor of 2....
#22
vishnu2709
closed
2 years ago
0
Aurora early access testbed makefile...
#21
vishnu2709
closed
2 years ago
0
Modified KUBO makefile
#20
vishnu2709
closed
2 years ago
0
Setting lattice type, documentation of settings?
#19
fospald
closed
2 years ago
1
Added documentation for MuST repository
#18
vishnu2709
closed
2 years ago
0
mst2 is interrupted in Tutorial CuZn/BCC, but B2 and Supercell work fine
#17
ysj7323
closed
2 years ago
2
INTEL folder not found and C compiler cannot create executables
#16
shipanhua
closed
2 years ago
5
Next