About
SPARK-MD is a general purpose reactive atomistic molecular and materials simulations progam package under active development in the Quantum Photoelectrochemistry group of Petter Persson.
First release in 2025.
Hydrogenation of nano-Si.
Cite
Program: SPARK-MD 1.0 (2025-02-08). P. Persson, Lund 2025
Manual: SPARK-MD 1.0 Manual (2025-02-08). hesperus.se/spark/spark_manual.html. P. Persson, Lund 2025
Contact
Petter Persson
Division of Computational Chemistry
Chemistry Department
Lund University
Sweden
Petter.Persson@compchem.lu.se
Latest Update
February 2025