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Refator:Use PARAM instead of nspin,cal_stress #5136

Merged
merged 36 commits into from
Sep 19, 2024
Merged

Refator:Use PARAM instead of nspin,cal_stress #5136

merged 36 commits into from
Sep 19, 2024

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A-006
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@A-006 A-006 commented Sep 19, 2024

Unit Tests and/or Case Tests for my changes

  • Change the unit test of nspin,cal_stress,two_fermi and DQ*

What's changed?

  • change the cpp file of npsin,cal_stress,two_fermi,and DQ*

A-006 and others added 30 commits September 16, 2024 20:33
@A-006
change paramter two_fermi in cpp file
802f830
@A-006
change two_fermi in test file
45a859e
@A-006
change cal_stress in the cpp file
ff99060
@A-006
change cal_stress in cpp file
9dab673
@A-006
change cal_stress in test file
b4e0bf3
@A-006
add dq,nqx,nqxq in system.cpp
ba25a36
@A-006
change dq
61bb238
@A-006
change dqx
c604c18
@A-006
change dqxq
4d58209
@A-006
fix bug in DQ
b79ea07
@A-006
Merge branch 'deepmodeling:develop' into para15
733e18e
@A-006
Merge branch 'deepmodeling:develop' into para15
1914cdf
@A-006
change parameter in gloabl variable
6aded95
@A-006
change file in PW_DIAG_THR
22d603d
@A-006
change file in PW_DIAG_THAR
2bb546c
@A-006
delete parameter in gloablV
d28c2b0
@A-006
change nspin in module_cell
f57839f
@A-006
change nspin in module_elecstate
9301eff
@A-006
change nspin in module_esolver
7e183ec
@A-006
change nspin in module_hamilt_lcao
bb6e20e
@A-006
change nspin in module_hamilt_pw
274d27c
@A-006
change nspin in module_hamilt_io
bcbe6e3
@A-006
change nspin
8535c0d
@A-006
change nspin in module_cell in test file
cfd6586
@A-006
change nspin in module_elecstate in test file
9fefd05
@A-006
change nspin in module_io in test file
024bbc8
@A-006
change nspin in module_xc in test file
48160bc
@A-006
change nspin in module_io in test file
4a5115b
@A-006
change nspin in module_psi in test file
c1ae027
@A-006
change nspin in test file
ce856d7
@Qianruipku Qianruipku merged commit 00df0e2 into deepmodeling:develop Sep 19, 2024
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@Qianruipku Qianruipku Qianruipku approved these changes

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@A-006 @Qianruipku