Results 91 to 100 of about 6,576 (123)

Fast and Fourier features for transfer learning of interatomic potentials. [PDF]

NPJ Comput Mater
Novelli P, Meanti G, Buigues PJ, Rosasco L, Parrinello M, Pontil M, Bonati L.   +6 more
europepmc   +1 more source

A Machine Learning Framework for Modeling Ensemble Properties of Atomically Disordered Materials. [PDF]

ACS Nano
Fang Z, Hsu TW, Yan Q.
europepmc   +1 more source

Adjoint <i>L</i>-functions, congruence ideals, and Selmer groups over GL n. [PDF]

Res Number Theory
Fong HL.
europepmc   +1 more source

GoFlow: efficient transition state geometry prediction with flow matching and E(3)-equivariant neural networks.

Digit Discov
Galustian L, Mark K, Karwounopoulos J, Kovar MP, Heid E.   +4 more
europepmc   +1 more source

Quadratic Subproduct Systems, Free Products, and Their C*-Algebras. [PDF]

Integr Equ Oper Theory
Arici F, Ge Y.
europepmc   +1 more source

Applications of representation theory and of explicit units to Leopoldt's conjecture. [PDF]

Res Number Theory
Ferri F, Johnston H.
europepmc   +1 more source

PiNN: Equivariant Neural Network Suite for Modeling Electrochemical Systems. [PDF]

J Chem Theory Comput
Li J, Knijff L, Zhang ZY, Andersson L, Zhang C.   +4 more
europepmc   +1 more source

Beyond Euclid: an illustrated guide to modern machine learning with geometric, topological, and algebraic structures. [PDF]

Mach Learn Sci Technol
Papillon M, Sanborn S, Mathe J, Cornelis L, Bertics A, Buracas D, J Lillemark H, Shewmake C, Dinc F, Pennec X, Miolane N.   +10 more
europepmc   +1 more source

Type-II neural symmetry detection with Lie theory. [PDF]

Sci Rep
Gabel A, Quax R, Gavves E.
europepmc   +1 more source

Machine Learning Force Fields in Electrochemistry: From Fundamentals to Applications. [PDF]

ACS Nano
Jinnouchi R, Minami S.
europepmc   +1 more source