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ksyang2013
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aimsgb
Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)
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Build GB with rotation angle
#16
an-stu
opened
2 months ago
0
Rotation Axis [111], Grain Boundary Plane (1 -2 1) is not generating the structure
#15
maaliso
opened
2 months ago
5
rotation axis with negative value
#14
PolyuWeldingSpock
closed
3 months ago
1
fix the bug that cause grain_a to be the same with grain_b
#13
jic198
closed
4 months ago
0
GBs along [110] direction
#12
YongliangOu
opened
5 months ago
1
Can not generate graphene grain boundary with [1 1 1] rotation axis
#11
tangjialin666
opened
10 months ago
6
replace `direction` by `axis` in `np.concatenate`
#10
samwaseda
closed
12 months ago
0
Pass through all args/kwargs in Grain.__init__
#9
pmrv
closed
12 months ago
0
Clean up the code and remove notebooks folder
#8
jic198
closed
1 year ago
0
New features of orthogonalizing a grain structure and using mp_id
#7
jic198
closed
1 year ago
0
No atoms in the grain boundary
#6
Vaibhav51093
closed
1 year ago
10
Odd terminations of grain boundaries
#5
j-m-dean
closed
1 year ago
3
Update grain.py
#4
ab5424
closed
2 years ago
0
how to combine the source code to your script?
#3
Weimin1029
closed
2 years ago
2
pymatgen 2021.03.04 comptaibility
#2
jan-janssen
closed
3 years ago
1
pip installation of aimsgb not giving the same as your homepage
#1
AleksBL
closed
1 year ago
6