computron

"""
Export phonon band structure data from the Materials Project API for visualization on the phonons web site (https://henriquemiranda.github.io/phononwebsite/phonon.html).
Author: Anubhav Jain (https://github.com/computron)
Related video tutorial on phonons: https://youtu.be/acT6zQbiiio

## Setup Instructions:
1. **Obtain an API Key:**
   - Register for an account at the Materials Project: https://materialsproject.org
   - Generate an API key from your account settings: https://materialsproject.org/api

computron

#!/usr/bin/env python3
"""
Script to get all your coauthors, last date of collaboration, and number of times collaborated
Author: Anubhav Jain (https://github.com/computron)
Video tutorial: https://youtu.be/vgEWvP3M02w

Troubleshooting:
1. Make sure you use quotes if there is a space, e.g., --institution "Stanford University" with quotes
2. Make sure you have a Scopus subscription; you may need to VPN into your institution or be on an institutional wifi network. e.g., this should solve "pybliometrics.scopus.exception.Scopus401Error: The requestor is not authorized to access the requested view or fields of the resource"
3. Try using the --authorid flag instead of --lastname, --firstname, and --institution. You can find an author id at: https://www.scopus.com/freelookup/form/author.uri

computron

"""
OVERVIEW: This script will automatically export a list of all your co-authors and
their institutions to an Excel file based on information already in the Scopus database.

LIMITATIONS:
1. Only up to 150 collaborators are supported by Scopus.
2. Sometimes, you want to filter by collaborators for only the last 4 years. Unfortunately, there
is no simple way to do this up front, but by enabling the years option you can filter at the end.

INSTRUCTIONS (these are actually important!):

computron

# Thanks to Shyam Dwaraknath!
# Make sure you have an API to SCOPUS set up

from pandas import DataFrame
from pybliometrics.scopus import AuthorRetrieval

author_number = 7404463800  # enter your Scopus author number here, look up on Scopus Author Search (free) https://www.scopus.com/freelookup/form/author.uri
au = AuthorRetrieval(author_number)
coauthors = DataFrame(au.get_coauthors())

computron

"""
OVERVIEW: This script will automatically export a list of all your co-authors and 
their institutions to an Excel file based on information already in the Scopus database.

LIMITATIONS:
1. Only up to 150 collaborators are supported by Scopus.
2. Sometimes, you want to filter by collaborators for only the last 4 years. Unfortunately, 
there is no simple way to do this.

INSTRUCTIONS:

computron

from pymatgen import Composition, Element, MPRester
from pymatgen.analysis.phase_diagram import PhaseDiagram

if __name__ == "__main__":

    # stuff the user needs to set
    MAPI_KEY = None
    FORMULA = "FeP2"
    OPEN_ELEMENT = "O"

computron

computron

from scopus import ScopusAuthor, ScopusAbstract

AUTHOR_SCOPUS_ID = """
Sumanjeet Kaur, 15071548400
Sean Lubner, 55895288700
Fuduo Ma, 55390403200
Ravi Prasher, 7004221271
Peiyuan Yu, 56412335300
Vivek Subramanian, 56504639000
David Suich, 55804751900

computron

computron

from pymatgen import MPRester, Spin, Element


def print_dos_data(dos):
    print("The Fermi energy is {}".format(dos.efermi))

    cols = ["energy", "total_dos", "up_dos", "down_dos"]
    energies = dos.energies
    total_dos = dos.get_densities()  # note that you can also get smeaered densities using a different function
    up_dos = dos.get_densities(Spin.up)