Stefan Niklaus Heinen

3PUBLICATIONS
9CO-AUTHORS
Organometallic chemistryData structures and algorithmsComputational chemistry
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Publications (3)

|May 01, 2026
Radical-Based On-Surface Transformation of Nonplanar Aromatics Into Nonbenzenoid Nanographenes.

|Jul 18, 2023
Kernel based quantum machine learning at record rate: Many-body distribution functionals as compact representations.

Danish Khan, Stefan Heinen, O Anatole von Lilienfeld

|Dec 22, 2022
Transition state search and geometry relaxation throughout chemical compound space with quantum machine learning.

Stefan Heinen, Guido Falk von Rudorff, O Anatole von Lilienfeld

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Frequent Collaborators

2 joint publications

O Anatole von Lilienfeld

1 joint publications

Guido Falk von Rudorff

1 joint publications

Danish Khan

1 joint publications

Daniel Rothhardt