Even Chiari, Wafa Makhlouf, Lucie Pepe, Saad Yalouz and coworkers published a new paper, “Ab initio polaritonic chemistry on diverse quantum computing platforms: Ansatz circuit design for qubit, qudit, and hybrid qubit-qumode architectures” in Physical Review A
Read moreEmmanuel Fromager and coworker published a new paper, “Density functional theory beyond the Born–Oppenheimer approximation: exact mapping onto an electronically non-interacting Kohn–Sham molecule”, in Electronic Structure
Read moreChristophe Gourlaouen and coworkers published a new paper, “Site-Selective Radical Aromatic C−H Functionalization of Alloxazine and Flavin through Ground-State Single Electron Transfer”, in Angewandte Chemie
Read moreFilip Cernatic and Emmanuel Fromager published a new paper, “Extended N-centered ensemble density functional theory of double electronic excitations”, in Journal of Computational Chemistry
Read moreChristophe Gourlaouen and coworkers published a new paper, “Keto–enol equilibrium: stable tautomers of ortho-, meta-, and para-hydroquinones in large aromatics”, in RSC Advances
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