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gpaw
gpaw
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Popularity
Simplify the DielectricFunctionCalculator constructor by disentangling it from the QEH module
!2306
· created
May 14, 2024
by
Thorbjørn Skovhus
Response
Sprint
in progress
Merged
17
Approved
updated
May 17, 2024
Remove n_n and m_m input for pair.get_occupation_differences
!2304
· created
May 14, 2024
by
Martin Ovesen
Response
Sprint
in progress
Merged
2
Approved
updated
May 17, 2024
allow users to add prefix to chi0.txt context
!2303
· created
May 14, 2024
by
Tara Maria Boland
Response
Sprint
ready
Merged
1
Approved
updated
May 14, 2024
Test for chi linear in nlopt
!2302
· created
May 14, 2024
by
Martin Ovesen
Response
Sprint
in progress
Merged
1
updated
May 14, 2024
make ibzq_qc cached_property
!2301
· created
May 14, 2024
by
Tara Maria Boland
Response
Sprint
ready
Merged
1
updated
May 14, 2024
Make dielectric function dataclasses independent of the Chi0DysonEquations
!2300
· created
May 14, 2024
by
Thorbjørn Skovhus
Response
Sprint
in progress
Merged
3
updated
May 14, 2024
Move polarizability functionality to the dielectric matrix and inverse dielectric function data objects.
!2299
· created
May 13, 2024
by
Thorbjørn Skovhus
Response
Sprint
in progress
Merged
2
Approved
updated
May 14, 2024
Unit Tests for coulomb_kernel.py
!2298
· created
May 13, 2024
by
Tara Maria Boland
Response
Sprint
ready
Tests
Merged
1
Approved
updated
May 14, 2024
Use atomic units during nlopt calculations
!2297
· created
May 13, 2024
by
Martin Ovesen
Response
Sprint
in progress
Merged
5
updated
May 14, 2024
Broadcast Errors
!2296
· created
May 13, 2024
by
Jens Jørgen Mortensen
Merged
1
updated
May 14, 2024
use qpd.optical_limit instead of qpd.kd.gamma solving rounding bug
!2295
· created
May 13, 2024
by
Ask Hjorth Larsen
Response
Sprint
in progress
Merged
4
updated
May 14, 2024
Skip eshift for RPA - not implemented
!2294
· created
May 13, 2024
by
Jens Jørgen Mortensen
Response
Sprint
in progress
Merged
3
updated
May 14, 2024
Order optimal orbitals after sic calculation
!2293
· created
May 13, 2024
by
Gianluca Levi
Merged
4
updated
May 16, 2024
Update Niflheim venv script for el8
!2291
· created
May 08, 2024
by
Jens Jørgen Mortensen
Merged
updated
May 08, 2024
Clean up mathematical redundancies in the Chi0DysonEquation
!2290
· created
May 08, 2024
by
Thorbjørn Skovhus
Response
Sprint
in progress
Merged
2
updated
May 14, 2024
DOC: Better message for users who don't register setups.
!2289
· created
May 07, 2024
by
Andrew Peterson
Merged
1
updated
May 08, 2024
Clean up dielectric matrix data
!2286
· created
May 07, 2024
by
Thorbjørn Skovhus
Response
Merged
1
updated
May 13, 2024
Test 2d dielectric function in agts
!2285
· created
May 07, 2024
by
Thorbjørn Skovhus
Response
Merged
1
updated
May 13, 2024
Minimal coupling between df and qeh
!2284
· created
May 07, 2024
by
Thorbjørn Skovhus
Response
Merged
6
Approved
updated
May 13, 2024
np.trapz -> scipy.integrate.trapezoid
!2283
· created
May 07, 2024
by
Jens Jørgen Mortensen
Merged
updated
May 07, 2024
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