Projects: pypi: matsci

https://packages.ecosyste.ms/registries/pypi.org/packages/matsci

Papers Mentioning matsci 2

10.3390/molecules20023371
A Density Functional Tight Binding Study of Acetic Acid Adsorption on Crystalline and Amorphous Surfaces of Titania
Cited by: 39
Author(s): Sergei Manzhos, Giacomo Giorgi, Koichi Yamashita
Software Mentions: 1
Published: over 11 years ago
10.1021/acs.jctc.0c01156
Curvature Constrained Splines for DFTB Repulsive Potential Parametrization
Cited by: 11
Author(s): Akshay Krishna Ammothum Kandy, Eddie Wadbro, Bálint Aradi, Peter Broqvist, Jolla Kullgren
Software Mentions: 1
Published: over 5 years ago