Klaus Doll

Publication Activity (10 Years)

Years Active: 2023-2024
Publications (10 Years): 2

Top Topics

Room Temperature

Invariant Features

Top Venues

J. Comput. Chem.

Publications

Fabien Pascale, Saber Gueddida, Klaus Doll, Roberto Dovesi
Band gap, Jahn-Teller deformation, octahedra rotation in transition metal perovskites LaTiO 3. J. Comput. Chem. 45 (10) (2024)
Fabien Pascale, Klaus Doll, Francesco Silvio Gentile, Roberto Dovesi
How deeply are core electrons perturbed when valence electrons are spin polarized? The case study of transition metal compounds. J. Comput. Chem. 44 (2) (2023)