Maryam Mansoori Kermani
4PUBLICATIONS
9CO-AUTHORS
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Publications (4)
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|Dec 17, 2025
Hydrogenation of ethylene over molybdenum-sulfur complexes supported on UiO-66.Maryam Mansoori Kermani, Matthew Neurock, Donald G Truhlar
|Aug 08, 2025
Subvalence Orbitals and Diffuse Functions in Accurate Electronic Structure Calculations: Insights from Nitrogenase Fe-S Dimer Clusters.Dayou Zhang, Maryam Mansoori Kermani, Donald G Truhlar
|Nov 19, 2024
Creating Benchmarks for Lithium Clusters and Using Them for Testing and Validation.Maryam Mansoori Kermani, Donald G Truhlar
|Feb 27, 2024
Modeling Multi-Step Organic Reactions: Can Density Functional Theory Deliver Misleading Chemistry?Hanwei Li, Maryam Mansoori Kermani, Alistar Ottochian
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Frequent Collaborators
4 joint publications
Donald G Truhlar
1 joint publications
Alistar Ottochian
1 joint publications
Orlando Crescenzi
1 joint publications
Benjamin G Janesko
1 joint publications
Giovanni Scalmani
1 joint publications
Ilaria Ciofini
1 joint publications
Carlo Adamo
1 joint publications
Dayou Zhang
1 joint publications
Matthew Neurock
