Alessandro Troisi

54PUBLICATIONS
83CO-AUTHORS
Computational chemistryPolymers and plasticsOrganometallic chemistryTheoretical quantum chemistryPhotochemistry
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Publications (54)

|Sep 08, 2026
Computation of Nonradiative Rates for High-Throughput Virtual Screening: Application to the Discovery of Potential TADF Molecules.

|Aug 12, 2026
PolyRapid: automated high-throughput screening of polymers using a computational workflow.

|Jun 30, 2026
Synthesis of Thieno[3,2-b]thiophene-Cored Hexacyclic Molecules Via the Pictet-Spengler Reaction.

|Jan 22, 2026
Predicting S1 TDDFT Energies from ZINDO Calculations Using Message-Passing ΔML with Electronically Informed Descriptors.

Adam Coxson, Ömer H Omar, Marcos Del Cueto

|Oct 09, 2025
Reactivity of organic photocatalysts displaying thermally activated delayed fluorescence (TADF): rationalizing unexpected differences between rates of quenching of the lowest singlet and triplet states.

Federica Fina, Caterina Bellatreccia, Xia Wu

|Aug 14, 2025
Models connecting microstructure and charge transport in disordered semiconducting polymers: from theories to digital design.

Colm Burke, Alessandro Troisi

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Frequent Collaborators

6 joint publications

Paola Carbone

6 joint publications

Xiaoyu Xie

5 joint publications

Marcos Del Cueto

5 joint publications

Tahereh Nematiaram