Visualitzant per autor "Ramos Cordoba, Eloy"
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Toward a Unique Definition of the Local Spin

Local spins: improved Hilbert-space analysis

Bonding quandary in the [Cu3S2]3+ core: Insights from the analysis of domain averaged fermi holes and the local spin

The Atomic orbitals of the topological atom

Communication: An approximation to Bader's topological atom

Local spin analysis and chemical bonding

Characterization and quantification of polyradical character

Diradical character from the local spin analysis

Two new constraints for the cumulant matrix

Development of new tools for local electron distribution analysis

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Oxidation states from wave function analysis

Bonding description of the Harpoon mechanism

Separation of dynamic and nondynamic correlation

The Coulomb Hole of Ne atom

Nine Question on Energy Decomposition Analysis

How Many Electrons Does a Molecular Electride Hold?

How Reliable Are Modern Density Functional Approximations to Simulate Vibrational Spectroscopies?

Spurious Oscillations Caused by Density Functional Approximations: Who is to Blame? Exchange or Correlation?

APOST-3D: Chemical concepts from wavefunction analysis