Giovanni Macetti
www.mendeley.com
0000-0001-9935-7955
CNRS / Université de Lorraine
4 papers found
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QM/ELMO: A Multi-Purpose Fully Quantum Mechanical Embedding Scheme Based on Extremely Localized Molecular Orbitals
Extending Libraries of Extremely Localized Molecular Orbitals to Metal Organic Frameworks: A Preliminary Investigation
Climbing Jacob’s Ladder of Structural Refinement: Introduction of a Localized Molecular Orbital-Based Embedding for Accurate X-ray Determinations of Hydrogen Atom Positions
Localized Molecular Orbital-Based Embedding Scheme for Correlated Methods
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