Added changelog

CHANGELOG.org

@@ -0,0 +1,5 @@
+* v1.0.1
+** Added
+   + New abstract data type (ADT) called "particle". The "phonon" and "electron" ADTs are now inherited from "particle".
+** Fixed
+   + Bug in the dipole correction of the e-ph matrix elements.

CITATION.cff

@@ -10,5 +10,5 @@ authors:
 repository-code: 'https://github.com/nakib/elphbolt'
 license: GPL-3.0-or-later
 commit: '1480608'
-version: 1.0.0
-date-released: '2021-12-12'
+version: 1.0.1
+date-released: '2021-02-08'

Dockerfile

@@ -37,7 +37,7 @@ RUN echo "$USERNAME ALL=(ALL) NOPASSWD:ALL" >> /etc/sudoers && \
 USER $USERNAME
 WORKDIR /home/$USERNAME
 
-# Install some other packages from Ubuntu repo
+# Install some other packages from Debian repo
 RUN sudo apt-get install -yq git nano make cmake gfortran mpich  \
     liblapack-dev libsymspg-dev && \
     sudo apt-get clean -q

README.org

@@ -12,7 +12,7 @@ Using /ab initio/ electron-phonon and phonon-phonon interactions and a fully wav
 - phonon and electronic contributions to the thermopower; and
 - effect of the mutual electron-phonon drag on the transport coefficients listed above.
 
-Stylistically, it is designed to be simple, small, fast, and extensible. Object oriented programming concepts are combined with the procedural style, which allows fast development, while resulting in a rather compact source (~ 6700 lines of code). The symmetries of the crystal are fully exploited and the transport active Fermi window is used to allow the sampling of extremely fine wave vector meshes needed for an accurate solution of the BTEs. Parallelism is achieved through modern Fortran's intrinsic ~coarrays~ feature that is fully supported by recent versions of both the ~gcc~ and ~intel~ compilers.
+Stylistically, it is designed to be simple, small, fast, and extensible. Object oriented programming concepts are combined with the procedural style, which allows fast development, while resulting in a rather compact source (~ 7500 lines of code, generated using David A. Wheeler's 'SLOCCount'). The symmetries of the crystal are fully exploited and the transport active Fermi window is used to allow the sampling of extremely fine wave vector meshes needed for an accurate solution of the BTEs. Parallelism is achieved through modern Fortran's intrinsic ~coarrays~ feature that is fully supported by recent versions of both the ~gcc~ and ~intel~ compilers.
 
 ~elphbolt~ currently works with the ~Quantum Espresso~ (https://www.quantum-espresso.org/) suite and its core module ~EPW~ (https://epw-code.org/) for the phonon quantities and the Wannier space information, respectively.
 

src/elphbolt.f90

@@ -17,7 +17,7 @@
 program elphbolt
   !! Author: Nakib Haider Protik
   !! Summary: Main driver program.
-  !! Version: 1.0.0
+  !! Version: 1.0.1
   !!
   !! elphbolt is a program for solving the coupled electron-phonon Boltzmann transport equations
   !! (e-ph BTEs) as formulated in https://arxiv.org/abs/2109.08547 (2021) with both the