Gabriel I. Pagola

According to our database, Gabriel I. Pagola authored at least 6 papers between 2012 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2024

An open science grid implementation of the steady state genetic algorithm for crystal structure prediction.

Kristal N. Varela, Gabriel I. Pagola, Albert M. Lund, Marta B. Ferraro, Anita M. Orendt, Julio C. Facelli

J. Comput. Sci., 2024

2023

On the axial chirality of leucoindigo.

Gabriel I. Pagola, Patricio F. Provasi, Marta B. Ferraro, Paolo Lazzeretti

J. Comput. Chem., 2023

2021

Physical achirality in geometrically chiral rotamers of hydrazine and boranylborane molecules.

Gabriel I. Pagola, Marta B. Ferraro, Patricio F. Provasi, Stefano Pelloni, Paolo Lazzeretti

J. Comput. Chem., 2021

2018

The influence of relativistic effects on nuclear magnetic resonance spin-spin coupling constant polarizabilities of H2O2, H2S2, H2Se2, and H2Te2.

Gabriel I. Pagola, Martin A. B. Larsen, Marta B. Ferraro, Stephan P. A. Sauer

J. Comput. Chem., 2018

2016

Computational study of basis set and electron correlation effects on anapole magnetizabilities of chiral molecules.

Natalia Zarycz, Patricio F. Provasi, Gabriel I. Pagola, Marta B. Ferraro, Stefano Pelloni, Paolo Lazzeretti

J. Comput. Chem., 2016

2012

Nuclear magnetic resonance J coupling constant polarizabilities of hydrogen peroxide: A basis set and correlation study.

Hanna Kjær, Monia R. Nielsen, Gabriel I. Pagola, Marta B. Ferraro, Paolo Lazzeretti, Stephan P. A. Sauer

J. Comput. Chem., 2012