fix the scattering plotting

arm61 · Oct 2, 2018 · 043e1ca · 043e1ca
1 parent 4fc497c
commit 043e1ca
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Showing 4 changed files with 5 additions and 6 deletions.
diff --git a/docs/source/conf.py b/docs/source/conf.py
@@ -60,9 +60,9 @@
 # built documents.
 #
 # The short X.Y version.
-version = '1.1.8'
+version = '1.1.9'
 # The full version, including alpha/beta/rc tags.
-release = '1.1.8'
+release = '1.1.9'
 
 # The language for content autogenerated by Sphinx. Refer to documentation
 # for a list of supported languages.

diff --git a/pylj/sample.py b/pylj/sample.py
@@ -476,8 +476,7 @@ def update_diffview(ax, system, average_diff, q):  # pragma: no cover
     # the range of q is chosen to give a representive range for the
     # interactions minimum is the reciprocal of the box length and the maximum
     # is the reciprocal of the van der Waals diameter of the argon atom
-    qw = np.logspace(np.log10(2 * np.pi / system.box_length), 10.47, num=1000,
-                     base=10)[200:]
+    qw = np.linspace(2 * np.pi / system.box_length, 10e10, 1000)[20:]
     i = np.zeros_like(qw)
     for j in range(0, len(qw)):
         i[j] = np.sum(3.644 * (np.sin(qw[j] * system.distances)) / (

diff --git a/pylj/util.py b/pylj/util.py
@@ -231,7 +231,7 @@ def __version__():  # pragma: no cover
     """This will print the number of the pylj version currently in use."""
     major = 1
     minor = 1
-    micro = 8
+    micro = 9
     print('pylj-{:d}.{:d}.{:d}'.format(major, minor, micro))
 
 

diff --git a/setup.py b/setup.py
@@ -17,7 +17,7 @@
 # versioning
 MAJOR = 1
 MINOR = 1
-MICRO = 8
+MICRO = 9
 ISRELEASED = True
 VERSION = '%d.%d.%d' % (MAJOR, MINOR, MICRO)