Orlando Crescenzi

6PUBLICATIONS
17CO-AUTHORS
Theoretical quantum chemistryTransition metal chemistryComputational chemistryOrganometallic chemistry
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Publications (6)

|Sep 10, 2026
Density Functional Analysis of Noncovalent 2- and 3-Body Interactions in Trimolecular Clusters.

|May 25, 2024
The interaction of thiocyanate with peptides-A computational study.

Orlando Crescenzi, Giuseppe Graziano

|Feb 27, 2024
Modeling Multi-Step Organic Reactions: Can Density Functional Theory Deliver Misleading Chemistry?

Hanwei Li, Maryam Mansoori Kermani, Alistar Ottochian

|Jul 14, 2023
Barrier Heights for Diels-Alder Transition States Leading to Pentacyclic Adducts: A Benchmark Study of Crowded, Strained Transition States of Large Molecules.

Maryam Mansoori Kermani, Hanwei Li, Alistar Ottochian

|Mar 10, 2022
Disentangling the Puzzling Regiochemistry of Thiol Addition to o-Quinones.

Maria L Alfieri, Alice Cariola, Lucia Panzella

|Aug 27, 2020
Proton-Sensitive Free-Radical Dimer Evolution Is a Critical Control Point for the Synthesis of Δ2,2-Bibenzothiazines.

Luca Valgimigli, Maria Laura Alfieri, Riccardo Amorati

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Frequent Collaborators

3 joint publications

Carlo Adamo

2 joint publications

Luca Valgimigli

2 joint publications

Alessandra Napolitano

2 joint publications

Marco d'Ischia