Search filters

List of works by Ilias Magoulas

Accurate ab initio structural parameters of the diatomic and triatomic van der Waals molecules (11)BNg (X(2)Π, A(2)Σ(+)) and (11)BNg2 (X̃(2)B1), Ng = (4)He, (20)Ne, (40)Ar, (84)Kr, and (132)Xe.

scientific article published on 21 May 2014

An ab initio study of the electronic structure of BF and BF+.

scientific article published on March 2013

An ab initio study of the electronic structure of boron arsenide, BAs

scientific article published on 01 October 2013

An ab initio study of the electronic structure of the boron oxide neutral (BO), cationic (BO⁺), and anionic (BO⁻) species.

scientific article published in September 2014

Application of the CC(P;Q) Hierarchy of Coupled-Cluster Methods to the Beryllium Dimer

scientific article published on 29 December 2017

Application of the coupled-cluster CC(P;Q) approaches to the magnesium dimer

scientific article published on 8 January 2019

Communication: Approaching exact quantum chemistry by cluster analysis of full configuration interaction quantum Monte Carlo wave functions

scientific article published on 21 October 2018

Femtosecond real-time probing of reactions MMXVII: The predissociation of sodium iodide in the A 0+ state

scientific article published in September 2017

Is Externally Corrected Coupled Cluster Always Better Than the Underlying Truncated Configuration Interaction?

scientific article published on 23 June 2021

Isoenergetic two-photon excitation enhances solvent-to-solute excited-state proton transfer

scientific article published on 01 December 2020

Optimization of the Reax force field for the lithium-oxygen system using a high fidelity charge model

scientific article published on 01 August 2020

Quantum computation solves a half-century-old enigma: Elusive vibrational states of magnesium dimer found

scientific article published on 03 April 2020

Recent developments in the general atomic and molecular electronic structure system

scientific article published on 01 April 2020

Steric effects in light-induced solvent proton abstraction

scientific article published on 02 September 2020

The Ground State Electronic Energy of Benzene

scientific article published on 06 October 2020

Paulina is supported by:

About Paulina

Help