C&EN

Modular Integration of Python Programming in Undergraduate Physical Chemistry Experiments

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Programming is a key transferable skill within the chemical sciences with applications ...
IEEE

Productivity, Portability, Performance, and Reproducibility: Data-Centric Python

Abstract: Python has become the de facto language for scientific computing. Programming in Python is highly productive, mainly due to its rich science-oriented software ecosystem built around the ...
C&EN

Acceleration of the Relativistic Dirac–Kohn–Sham Method with GPU: A Pre-Exascale Implementation of BERTHA and PyBERTHA

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. In this paper, we present the recent advances in the computation of the ...
GitHub

Numpy--random module in numpy Part-1.txt

Syntax-2: numpy.random.randint(Low,High)-----> Random number between Low to High-1 Syntax-2: numpy.random.randint(Low,High,size)----- Random number between Low to ...
ag.purdue

Working with Python's built-in file methods tutorial

Everything on a computer is at its core a binary number, since computers do everything with bits that represent 0 and 1. In order to have a file that is "plain text", so human readable with minimal ...