Journal Articles by I. Saha
I. Saha,
D. Willimetz and
L. Grajciar
<scp>CRISP</scp> : Enhancing <scp>ASE</scp> Workflows With Advanced Molecular Simulation Post‐Processing
<scp>CRISP</scp> : Enhancing <scp>ASE</scp> Workflows With Advanced Molecular Simulation Post‐Processing
Journal of Computational Chemistry,
47(13),
2026
A. Erlebach,
M. Šípka,
I. Saha,
P. Nachtigall,
C. J. Heard and
L. Grajciar
A reactive neural network framework for water-loaded acidic zeolites
A reactive neural network framework for water-loaded acidic zeolites
Nature Communications,
15(1),
2024
I. Saha,
A. Erlebach,
P. Nachtigall,
C. J. Heard and
L. Grajciar
Germanium distributions in zeolites derived from neural network potentials
Germanium distributions in zeolites derived from neural network potentials
Catalysis Science & Technology,
2024