Advanced Building Techniques
Crystal
Setup
A PBC‐DFT study of electronic properties of substituted polythiophenes - Vikramaditya - 2015 - Journal of Physical Organic Chemistry - Wiley Online Library
XO-PBC: An Accurate and Efficient Method for Molecular Crystals | Journal of Chemical Theory and Computation
Presentation Title
PBC in Gaussian (Polymer-Pyrrole) | اجراء الحسابات لمركب بوليميري - YouTube
Modelling Instructions: CAChe
Extrapolation of polymer gap by combining cluster and periodic boundary condition calculations with Hückel theory - ScienceDirect
Crystal
Table of Contents
Setup
Introduction to Gaussian & GaussView - ppt video online download
Single Point Lab
pbctut4_5.jpg
Gaussian Input Files | Computational Chemistry Resources
How to add a non-periodic structure to a model with a periodic structure in an gaussian program? | ResearchGate
Setting Up and Running Gaussian Jobs
Leave a question! – Dr. Joaquin Barroso's Blog
WebMO Help
Crystal
Single Point Lab
PBC Guide | PDF | Crystal Structure | Condensed Matter Physics
GaussView 6
Using GaussView 6 | Gaussian.com
