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List of works by Simone Salustro

Characterization of the B-Center Defect in Diamond through the Vibrational Spectrum: A Quantum-Mechanical Approach.

scientific article published on 13 December 2017

Interstitial nitrogen atoms in diamond. A quantum mechanical investigation of its electronic and vibrational properties

article

Looking for $$sp^2$$ s p 2 carbon atoms in diamond: a quantum mechanical study of interacting vacancies

article

Low energy excitations in NiO based on a direct Δ-SCF approach

article

On the Models for the Investigation of Charged Defects in Solids: The Case of the VN- Defect in Diamond

scientific article published on 24 May 2019

Raman spectrum of NaAlSi2O6jadeite. A quantum mechanical simulation

Substitutional boron and nitrogen pairs in diamond. A quantum mechanical vibrational analysis

article

Substitutional nitrogen in diamond: A quantum mechanical investigation of the electronic and spectroscopic properties

article

The A-center defect in diamond: quantum mechanical characterization through the infrared spectrum

The CRYSTAL code, 1976-2020 and beyond, a long story

scientific article published on 01 May 2020

The V + I defects in diamond: An ab initio investigation of the electronic structure, of the Raman and IR spectra, and of their possible recombination.

scientific article published on November 2016

The VN3H defect in diamond: a quantum-mechanical characterization.

scientific article

The characterization of the VN x H y defects in diamond through the infrared vibrational spectrum. A quantum mechanical investigation

scholarly article in Carbon, vol. 132, June 2018

The electronic states of the neutral vacancy in diamond: a quantum mechanical approach

The spectroscopic characterization of interstitial oxygen in bulk silicon: A quantum mechanical simulation

scientific article published on 01 February 2020

Vibrational spectroscopy of hydrogens in diamond: a quantum mechanical treatment

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