This code extracts line width of phonons from specular energy density (SED) calculated with LAMMPS.

Related tags

Miscellaneousmd2tau
Overview

dump2sed and sed2tau

This code extracts linewidth of phonons from a specular energy density (SED) calculated with LAMMPS.

dump2sed

  • To calculate spectral energy density (SED) from a dump file of LAMMPS

sed2tau

  • To extract linewidth or lifetime of phonons from SEDs

Prerequisite

  • python>=3.0
  • lmfit

References

  • M. Ohnishi and J. Shiomi, Phys. Rev. B 104, 014306 (2021).
  • T. Kodama, M. Ohnishi, et. al. Nat. Mater. 16, 892-897 (2017).
Owner
Masato Ohnishi
Masato Ohnishi
PyDateWaiter helps waiting special day & calculating remain days till that day with Python code.

PyDateWaiter (v.Beta) PyDateWaiter helps waiting special day(aniversary) & calculating remain days till that day with Python code. Made by wallga gith

wallga 1 Jan 14, 2022
Exercicios de Python do Curso Em Video, apresentado por Gustavo Guanabara.

Exercicios Curso Em Video de Python Exercicios de Python do Curso Em Video, apresentado por Gustavo Guanabara. OBS.: Na data de postagem deste repo já

Lorenzo Ribeiro Varalo 0 Oct 21, 2021
Enhanced version of blender's bvh add-on with more settings supported. The bvh's rest pose should have the same handedness as the armature while could use a different up/forward definiton.

Enhanced bvh add-on (importer/exporter) for blender Enhanced bvh add-on (importer/exporter) for blender Enhanced bvh importer Enhanced bvh exporter Ho

James Zhao 16 Dec 20, 2022
A Lite Package focuses on making overwrite and mending functions easier and more flexible.

Overwrite Make Overwrite More flexible In Python A Lite Package focuses on making overwrite and mending functions easier and more flexible. Certain Me

2 Jun 15, 2022
Simulation simplifiée du fonctionnement du protocole RIP

ProjetRIPlay v2 Simulation simplifiée du fonctionnement du protocole RIP par Eric Buonocore le 18/01/2022 Sur la base de l'exercice 5 du sujet zéro du

Eric Buonocore 2 Feb 15, 2022
Inviare messaggi tramite app IO a partire da dati contenuti in file .csv

parlaConIO Inviare messaggi tramite app IO a partire da dati contenuti in file .csv -- Nessun obbligo, ma in caso di clonazione o uso del programma c

Francesco Del Castillo 6 Aug 22, 2022
CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.

CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.

pycalphad 189 Dec 13, 2022
Voldemort's Python import helper

importmagician Voldemort's Python import helper pip install importmagician Import from uninstalled Python directories Say you have a directory (relat

Zhengyang Feng 4 Mar 09, 2022
A Blender addon for VSE that auto-adjusts video strip's length, if speed effect is applied.

Blender VSE Speed Adjust Addon When using Video Sequence Editor in Blender, the speed effect strip doesn't auto-adjusts clip length when changing its

Arpit Srivastava 2 Jan 18, 2022
Let's pretend you want to create a AWS Lambda project called "sns-processor".

Usage Let's pretend you want to create a AWS Lambda project called "sns-processor". Rather than using lambda and then editing the results to include y

1 Dec 31, 2021
Заглушки .NET библиотек для IronPython

Код репозитория основан на ironpython-stubs. Выражаю gtalarico бесконечную благодарность за вклад в развитие сообщества разработчиков скриптов и плаги

12 Nov 23, 2022
Minimalist BERT implementation assignment for CS11-747

minbert Assignment by Zhengbao Jiang, Shuyan Zhou, and Ritam Dutt This is an exercise in developing a minimalist version of BERT, part of Carnegie Mel

Graham Neubig 51 Jan 03, 2023
Monochrome's API, implemented with Deta Base and Deta Drive.

Monochrome Monochrome's API, implemented with Deta Base and Deta Drive. Create a free account on Deta to test this out! Most users will prefer the Mon

Monochrome 5 Sep 22, 2022
Repo to demo translating colab/jupyter notebook to streamlit webapp

Repo to demo translating colab/jupyter notebook to streamlit webapp

Marisa Smith 2 Feb 02, 2022
log4shell pwner for vulnerable minecraft servers

Log4-hell name supposed to be Log4$hell but oh well log4shell pwner for vulnerable minecraft servers install all reqs python + a minecraft client for

1 Jan 05, 2022
System Information Utility With Python

System-Information-Utility This is a simple utility, for the terminal, which allows you to find out information about your PC. It's very easy to run t

2 Apr 15, 2022
Lectures for Udemy - Complete Python Bootcamp Course

Complete-Python-Bootcamp Welcome to the Repository for the Complete Python Bootcamp! This is the Repository for the Udemy course - "Complete Python Bo

Marci 2k Dec 28, 2022
pvaPy provides Python bindings for EPICS pvAccess

PvaPy - PvAccess for Python The PvaPy package is a Python API for EPICS7. It supports both PVA and CA providers, all standard EPICS7 types (structures

EPICS Base 25 Dec 05, 2022
Web interface for browsing, search and filtering recent arxiv submissions

Web interface for browsing, search and filtering recent arxiv submissions

Andrej 4.8k Jan 08, 2023
Скрипт позволяет заводить задачи в Панель мониторинга YouTrack на основе парсинга сайта safe-surf.ru

Скрипт позволяет заводить задачи в Панель мониторинга YouTrack на основе парсинга сайта safe-surf.ru

Bad_karma 3 Feb 12, 2022