Stability-Aware Training of Neural Network Interatomic Potentials with Differentiable Boltzmann Estimators. - Sanjeev Raja; Ishan Amin; Fabian Pedregosa; Aditi S. Krishnapriyan (CoRR, 2024)

Towards Fast, Specialized Machine Learning Force Fields: Distilling Foundation Models via Energy Hessians. - Ishan Amin; Sanjeev Raja; Aditi S. Krishnapriyan (ICLR, 2025)

Stability-Aware Training of Machine Learning Force Fields with Differentiable Boltzmann Estimators. - Sanjeev Raja; Ishan Amin; Fabian Pedregosa; Aditi S. Krishnapriyan (Trans. Mach. Learn. Res., 2025)