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Theoretical and Computational Chemistry

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Tomás Rocha-Rinza

2 results in Authors: Tomás Rocha-Rinza

Theoretical and Computational Chemistry

Towards an Atomistic Understanding of Polymorphism in Molecular Solids

Arturo Sauza-de la Vega, Leonardo J. Duarte, arnaldo silva, Jonathan Skelton, Tomás Rocha-Rinza, Paul Popelier

Version 1 posted 13 April 2021

392

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Theoretical and Computational Chemistry

DFT Performance in the IQA Energy Partition of Small Water Clusters

Fernando Jiménez-Grávalos, José Luis Casals-Sainz, Evelio Francisco, Tomás Rocha-Rinza, Angel Martín Pendás, Jose Manuel Guevara-Vela

Version 1 posted 12 August 2019

619

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