SPECI
Getting Started
Installation
General Input Files
Input Settings
Additional Settings for Advanced Users
General Output Files
Examples
Solvent Coordination: Example Case Study (LiTMP/THF)
Actinide Complexes: Example Case Study
Bimetallic IIP: Example Case Study
Automated Microkinetic Modelling
AUTOCOPASI: Installation & Setup
Example Usage: SPECI-AUTOCOPASI Integration
SPECI
Index
Index