Merge branch 'main' into develop

issp-center-dev · Jan 31, 2025 · 694e75a · 694e75a
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diff --git a/README.md b/README.md
@@ -48,6 +48,11 @@ This software was developed with the support of
 "Project for Advancement of Software Usability in Materials Science"
 of The Institute for Solid State Physics, The University of Tokyo.
 
+We would appreciate it if you cite the following article in your research with H-wave:
+H-wave -- A Python package for the Hartree-Fock approximation and the random phase approximation,
+Tatsumi Aoyama, Kazuyoshi Yoshimi, Kota Ido, Yuichi Motoyama, Taiki Kawamura, Takahiro Misawa, Takeo Kato, and Akito Kobayashi,
+[Computer Physics Communications, 298, 109087 (2024)](https://doi.org/10.1016/j.cpc.2024.109087).
+
 ## Official page
 
 - [H-wave project site](https://www.pasums.issp.u-tokyo.ac.jp/h-wave/en)

diff --git a/docs/en/source/howtouse/ho-index.rst b/docs/en/source/howtouse/ho-index.rst
@@ -28,7 +28,7 @@ Basic usage
 
     .. code-block:: bash
 
-       $ pip install h-wave
+       $ pip install hwave
 
   - From source:
 

diff --git a/docs/ja/source/howtouse/ho-index.rst b/docs/ja/source/howtouse/ho-index.rst
@@ -37,7 +37,7 @@
 
       .. code-block:: bash
 
-        $ pip install h-wave
+        $ pip install hwave
 
     - ソースパッケージから
 

diff --git a/docs/ja/source/index.rst b/docs/ja/source/index.rst
@@ -3,6 +3,7 @@ H-waveのドキュメントへようこそ！
 #####################################################
 
 
+
 Contents
 -----------
 

diff --git a/docs/tutorial/Hubbard/RPA/input.toml b/docs/tutorial/Hubbard/RPA/input.toml
@@ -21,7 +21,7 @@
   # chi0q_init = "chi0q.npz"
 
 [file.input.interaction]
-  path_to_input = "input"
+  path_to_input = "."
   Geometry = "geom.dat"
   Transfer = "transfer.dat"
   CoulombIntra = "coulombintra.dat"

diff --git a/docs/tutorial/Hubbard/UHFr/greenone.def b/docs/tutorial/Hubbard/UHFr/greenone.def
@@ -0,0 +1,15 @@
+===============================
+NCisAjs         16
+===============================
+======== Green functions ======
+===============================
+    0     0     0     0
+    0     1     0     1
+    1     0     1     0
+    1     1     1     1
+    2     0     2     0
+    2     1     2     1
+    3     0     3     0
+    3     1     3     1
+    4     0     4     0
+    4     1     4     1
diff --git a/sample/RPA/input.toml b/sample/RPA/input.toml
@@ -4,7 +4,7 @@
 [mode]
   mode = "RPA"
   # enable_spin_orbital = false
-  # calc_scheme = "general"
+  calc_scheme = "general"
 
 [mode.param]
   T = 0.5
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Expand Up		@@ -3,6 +3,7 @@ H-waveのドキュメントへようこそ！
		#####################################################



		Contents
		-----------

Expand Down