xyz2FHIaims

it exchanges .xyz files to FHI-aims geometry.in shape

Brought to you by: mersadkhan

Add a Review

Downloads: 0 This Week

Last Update: 2015-02-26

Browse Code

Get an email when there's a new version of xyz2FHIaims

FHI-aims is a DFT package. one of its input files is geometry.in. avogadro is a software for produce molecules and atomic structures that give you geometry files with "xyz" suffix. xyz2FHIaims change this "xyz" file to a suitable file for FHI-aims.

Project Activity

See All Activity >

Follow xyz2FHIaims

xyz2FHIaims Web Site

Other Useful Business Software

Auth0 for AI Agents now in GA

Ready to implement AI with confidence (without sacrificing security)?

Connect your AI agents to apps and data more securely, give users control over the actions AI agents can perform and the data they can access, and enable human confirmation for critical agent actions.

Start building today

Rate This Project

User Reviews

Be the first to post a review of xyz2FHIaims!

Additional Project Details

Registered

2015-02-26

Report inappropriate content

Recommended Projects

xyz2eps
python command line utility to print xyz-geometry to eps file format.
PyMOlyze
PyMOlyze is a graphical program to analyze the results of quantum chemistry (HF/DFT) calculations. Features include various population analyses, fragment analysis, monitoring structures during an optimization, and a simple, but powerful, XYZ editor.
csvdiff
compare csv files with any separator you want
LiVT
Create a variety of visualisations from high-resolution DTM
Peripheral MIDI Controller
Peripheral MIDI Controller (pmidic) is a software program that intends to act as a MIDI controller by using various peripheral devices. The initial release(s) will be focused on using a webcam as a MIDI controller with 3 dimensions (XYZ).