Thais Scott

4PUBLICATIONS
178CO-AUTHORS
Formal methods for softwareMain group metal chemistryProgramming languagesTheoretical quantum chemistry
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Publications (4)

|Sep 10, 2026
The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project.

|Mar 04, 2026
Multireference Modeling Reveals the Origins of L‑Edge X‑ray Absorption Features in Photoredox-Active Nickel Complexes.

Olivia Ho, Shawna Lin, Thais R Scott

|May 22, 2023
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry.

Giovanni Li Manni, Ignacio Fdez Galván, Ali Alavi

|Feb 20, 2019
A Multireference Ab Initio Study of the Diradical Isomers of Pyrazine.

Thais Scott, Reed Nieman, Adam Luxon

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Frequent Collaborators

3 joint publications

Laura Gagliardi

2 joint publications

Susi Lehtola

2 joint publications

Hans Lischka

2 joint publications

Matthew R Hermes