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skelton-group
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Phonopy-Spectroscopy
A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.
MIT License
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IR peaks are all zero
#24
aabishekk
opened
2 months ago
0
IndexError: list index out of range
#23
acammarat
opened
6 months ago
0
Asking Experimental Data of Phenol Phonon Spectroscopy
#22
zohansyahfatomi
opened
1 year ago
0
Error in "Irreps.yaml" file
#21
SHNEHABISWAS
opened
1 year ago
0
Irreducible representations read from "irreps.yaml"
#20
Weimin1029
opened
1 year ago
0
Packaging
#19
lucydot
opened
1 year ago
1
Tests
#18
lucydot
opened
1 year ago
0
Documentation
#17
lucydot
opened
1 year ago
0
phonopy-spectroscopy installation ---No module named 'spectroscopy'
#16
weotao
closed
1 year ago
2
#phonopy-spectroscopy installation
#15
suneetha98
closed
1 year ago
6
a warning is displayed:invalid value encountered in divide
#14
studyvasp
opened
1 year ago
2
I have a question about the command line
#13
smismyname
closed
1 year ago
2
Updated plotting for polar plots
#12
orchi-ia
closed
1 year ago
0
Installation instructions need updating
#11
ThijsSmolders
closed
1 year ago
1
Group theory update and some crystal plane rotation code
#10
orchi-ia
closed
1 year ago
0
Updated to agree with PEP8 standards.
#9
orchi-ia
closed
1 year ago
0
requesting more information
#8
iowachem
closed
1 year ago
2
TypeError: load() missing 1 required positional argument 'Loader'
#7
MajestyV
closed
1 year ago
1
Calculating phenol IR with using phonopy-ir and Quantum Espresso
#6
armin55fp
closed
2 years ago
3
Error: phonopy-raman: unrecognized arguments
#5
KaonashiCN
closed
2 years ago
2
strange "redshift" of sqrt(2) when using PWSCF
#4
chrisewolf
closed
4 years ago
2
Error: The number of bands references in the ir. rep. groups is more than # modes = 24.
#3
PujaAdhikari
closed
6 years ago
9
Error: Ir. reps. are required for the Gamma point modes
#2
PujaAdhikari
closed
6 years ago
2
Cannot generate mesh.yaml
#1
liuyuhang599
closed
6 years ago
12