16 citations · 24 across the 3 of their papers we have counts for
3 papers
physics.chem-ph2025★ 3 cited
Breakdown of broken-symmetry approach to exchange interaction
Naoya Iwahara, Zhishuo Huang, Akseli Mansikkamäki +1
Broken-symmetry (BS) approaches are widely employed to evaluate Heisenberg exchange parameters, primarily in combination with DFT calculations. For many magnetic materials, BS-DFT…
cond-mat.str-el2020★ 5 cited
Broken symmetry approach for the evaluation of exchange coupling constants
Akseli Mansikkamäki, Zhishou Huang, Naoya Iwahara +1
The applicability of a broken symmetry version of the approximation to the calculation of isotropic exchange coupling constants has been studied. Using a simple H--He--H m…
physics.chem-ph2018★ 16 cited
Interplay of spin-dependent delocalization and magnetic anisotropy in the ground and excited states of [Gd@C] and [Gd@C]
Akseli Mansikkamäki, Alexey A. Popov, Qingming Deng +2
The magnetic properties and electronic structure of the ground and excited states of two recently characterized endohedral metallo-fullerenes, [Gd@C] (1) and [Gd$_…