Concepedia

Gerardo Raggi

GR

Statistics

Publications

10

Citations

530

H-Index

10

Active since

2013

Affiliations

Uppsala University(Current)

University of Nottingham

Nantes Université

Chimie et Interdisciplinarité, Synthèse, Analyse, Modélisation

Centre National de la Recherche Scientifique

Gerardo Raggi is an author at Uppsala University specializing in natural sciences, chemistry, and computational chemistry.

Publications per year

2013–2023

10

Publications

10

The OpenMolcas <i>Web</i> : A Community-Driven Approach to Advancing Computational Chemistry

Giovanni Li Manni, Ignacio Fdez. Galván, Ali Alavi et al. · Journal of Chemical Theory and Computation · 2023 · 342 citations · Full text

, , +15

Restricted-Variance Molecular Geometry Optimization Based on Gradient-Enhanced Kriging

Gerardo Raggi, Ignacio Fdez. Galván, Christian L. Ritterhoff et al. · Journal of Chemical Theory and Computation · 2020 · 47 citations · Full text

, , +16

Restricted-Variance Constrained, Reaction Path, and Transition State Molecular Optimizations Using Gradient-Enhanced Kriging

Ignacio Fdez. Galván, Gerardo Raggi, Roland Lindh · Journal of Chemical Theory and Computation · 2020 · 38 citations · Full text

, , +13

Halogen Bond of Halonium Ions: Benchmarking DFT Methods for the Description of NMR Chemical Shifts

Daniel Sethio, Gerardo Raggi, Roland Lindh et al. · Journal of Chemical Theory and Computation · 2020 · 26 citations · Full text

, , +13

Experimental Binding Energies for the Metal Complexes [Mg(NH<sub>3</sub>)<sub><i>n</i></sub>]<sup>2+</sup>, [Ca(NH<sub>3</sub>)<sub><i>n</i></sub>]<sup>2+</sup>, and [Sr(NH<sub>3</sub>)<sub><i>n</i></sub>]<sup>2+</sup> for <i>n</i> = 4–20 Determined from Kinetic Energy Release Measurements

E. Bruzzi, Gerardo Raggi, Rajendra Parajuli et al. · The Journal of Physical Chemistry A · 2014 · 16 citations

, , +14

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