0.1.155

PyPI/setup.cfg

@@ -1,7 +1,7 @@
 [metadata]
 # replace with your username:
 name = guan
-version = 0.1.154
+version = 0.1.155
 author = guanjihuan
 author_email = guanjihuan@163.com
 description = An open source python package

PyPI/src/guan.egg-info/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.2
 Name: guan
-Version: 0.1.154
+Version: 0.1.155
 Summary: An open source python package
 Home-page: https://py.guanjihuan.com
 Author: guanjihuan

PyPI/src/guan.egg-info/SOURCES.txt

@@ -8,12 +8,14 @@ src/guan/Hamiltonian_of_examples.py
 src/guan/__init__.py
 src/guan/band_structures_and_wave_functions.py
 src/guan/basic_functions.py
+src/guan/custom_classes.py
 src/guan/data_processing.py
 src/guan/decorators.py
 src/guan/density_of_states.py
 src/guan/deprecated.py
 src/guan/figure_plotting.py
 src/guan/file_reading_and_writing.py
+src/guan/functions_using_objects_of_custom_classes.py
 src/guan/machine_learning.py
 src/guan/quantum_transport.py
 src/guan/topological_invariant.py

PyPI/src/guan/__init__.py

@@ -13,5 +13,7 @@ from .file_reading_and_writing import *
 from .figure_plotting import *
 from .data_processing import *
 from .decorators import *
+from .custom_classes import *
+from .functions_using_objects_of_custom_classes import *
 from .deprecated import *
 statistics_of_guan_package()

PyPI/src/guan/custom_classes.py

@@ -0,0 +1,11 @@
+# Module: custom_classes
+
+# 原子类
+class Atom:
+    def __init__(self, name='atom', index=0, x=0, y=0, z=0, energy=0):
+        self.name = name
+        self.index = index
+        self.x = x
+        self.y = y
+        self.z = z
+        self.energy = energy

PyPI/src/guan/figure_plotting.py

@@ -12,6 +12,38 @@ def import_plt_and_start_fig_ax(adjust_bottom=0.2, adjust_left=0.2, labelsize=20
         [label.set_fontname('Times New Roman') for label in labels]
     return plt, fig, ax
 
+# 导入plt, fig, ax（不显示坐标）
+def import_plt_and_start_fig_ax_without_axis():
+    import matplotlib.pyplot as plt
+    fig, ax = plt.subplots()
+    plt.subplots_adjust(left=0, bottom=0, right=1, top=1)
+    plt.axis('off')
+    return plt, fig, ax
+
+# 保存图片为所有常见的格式
+def savefig_with_all_formats(plt, filename, more_dpi=1, tiff=0):
+    plt.savefig(filename+'.eps')
+    plt.savefig(filename+'.svg')
+    plt.savefig(filename+'.pdf')
+    plt.savefig(filename+'.jpg')
+    plt.savefig(filename+'.png')
+    if tiff:
+        plt.savefig(filename+'.tiff')
+    if more_dpi:
+        try:
+            plt.savefig(filename+'_dpi=300.jpg', dpi=300)
+            plt.savefig(filename+'_dpi=600.jpg', dpi=600)
+            plt.savefig(filename+'_dpi=1000.jpg', dpi=1000)
+            plt.savefig(filename+'_dpi=300.png', dpi=300)
+            plt.savefig(filename+'_dpi=600.png', dpi=600)
+            plt.savefig(filename+'_dpi=1000.png', dpi=1000)
+            if tiff:
+                plt.savefig(filename+'_dpi=300.tiff', dpi=300)
+                plt.savefig(filename+'_dpi=600.tiff', dpi=600)
+                plt.savefig(filename+'_dpi=1000.tiff', dpi=1000)
+        except:
+            pass
+
 # 基于plt, fig, ax画图
 def plot_without_starting_fig_ax(plt, fig, ax, x_array, y_array, xlabel='x', ylabel='y', title='', fontsize=20, style='', y_min=None, y_max=None, linewidth=None, markersize=None, color=None, fontfamily='Times New Roman'): 
     if color==None:

PyPI/src/guan/functions_using_objects_of_custom_classes.py

@@ -0,0 +1,21 @@
+# functions_using_objects_of_custom_classes
+
+# 从原子对象列表中获取 (x, y) 坐标数组
+def get_coordinate_array_from_atom_object_list(atom_object_list):
+    coordinate_array = []
+    for atom in atom_object_list:
+        x = atom.x
+        y = atom.y
+        coordinate_array.append([x, y])
+    return coordinate_array
+
+# 根据原子对象列表来初始化哈密顿量
+def initialize_hamiltonian_from_atom_object_list(atom_object_list):
+    import numpy as np
+    import guan
+    dim = guan.dimension_of_array(atom_object_list[0].energy)
+    num = len(atom_object_list)
+    hamiltonian = np.zeros((dim*num, dim*num))
+    for i0 in range(num):
+        hamiltonian[i0*dim+0:i0*dim+dim, i0*dim+0:i0*dim+dim] = atom_object_list[i0].energy
+    return hamiltonian