Cesar Mello
Research Subjects
Cesar Mello has a total of 98 co-authors. Here are the top co-authors by number of shared publications:
- Ronei Jesus Poppi
Institute of Chemistry, University of Campinas, 13084-971 Campinas, SP, Brazil
16 shared publications - Katia Jorge Ciuffi
Universidade de Franca
10 shared publications Diórginis Ribeiro
Universidade de Franca 1 Instituto de Química Franca, SP, Brazil
5 shared publicationsEduardo J. Nassar
Department of Chemistry, Universidade de Franca, Av. Dr. Armando Salles de Oliveira, 201, CP. 82-CEP, 14404-600 Franca, SP, Brazil
4 shared publications- Lucas Alonso Rocha
Hybrid Lamellar Materials Research Group (GPMatLam), Parque Universitário, University of Franca, Av. Dr. Armando Salles Oliveira, 201, Franca 14404-600, SP, Brazil
4 shared publications - Marco Flôres Ferrão
Institute of Chemistry, Federal University of Rio Grande do Sul, Porto Alegre, Brazil
4 shared publications
Latest Publications
- 17 September 2026
- Published by Elsevier in Next Research
- Vol. 13
A spectral–geometric tensor framework beyond Hartree–Fock and Kohn–Sham closure
- 17 September 2026
- Published by Elsevier in Next Research
- Vol. 13
A spectral–geometric tensor framework beyond Hartree–Fock and Kohn–Sham closure
- 30 April 2026
- Published by Elsevier in Polyhedron
- Vol. 294
Electronic-state assignment in inorganic chemistry
- 30 April 2026
- Published by Elsevier in Polyhedron
- Vol. 294
Electronic-state assignment in inorganic chemistry
- 25 April 2026
- Published by Elsevier in Chemical Physics
- Vol. 608
The Hamiltonian–Topological Transform from atoms to frontier orbitals
- 25 April 2026
- Published by Elsevier in Chemical Physics
- Vol. 608
The Hamiltonian–Topological Transform from atoms to frontier orbitals
- Open Access
- 15 April 2026
- Published by Elsevier in SSRN Electronic Journal
Spectral Reduction and Internal Feshbach Closure in a Confining Yang–Mills Mass-Gap Model
A controlled spectral reduction is developed for a confining self-adjoint mass-gap model in order to determine when a positive reduced low-energy gap retains genuine mathematical credibility. The analysis is carried out for an anharmonic Schrödinger operator used as an explicit spectral testbed. A Euclidean seed is first extracted for the low-energy scale, reproducing the correct first perturbative trend. Exact parity decomposition is then performed, followed by finite-rank spectral compression onto short even and odd harmonic blocks. The discarded complement is subsequently restored through an internal Schur–Feshbach closure, replacing the bare truncated gap by a corrected reduced quantity. Within this setting, a positive reduced gap becomes spectrally meaningful only when exact sector resolution, finite-rank restriction, and complement closure are imposed in the proper order. The resulting construction is proposed as a methodological and operator-theoretic benchmark for Yang–Millsrelated mass-gap settings, without identifying the model with four-dimensional Yang–Mills theory itself.
- 15 April 2026
- Published by Elsevier in SSRN Electronic Journal
Open AccessSpectral Reduction and Internal Feshbach Closure in a Confining Yang–Mills Mass-Gap Model
A controlled spectral reduction is developed for a confining self-adjoint mass-gap model in order to determine when a positive reduced low-energy gap retains genuine mathematical credibility. The analysis is carried out for an anharmonic Schrödinger operator used as an explicit spectral testbed. A Euclidean seed is first extracted for the low-energy scale, reproducing the correct first perturbative trend. Exact parity decomposition is then performed, followed by finite-rank spectral compression onto short even and odd harmonic blocks. The discarded complement is subsequently restored through an internal Schur–Feshbach closure, replacing the bare truncated gap by a corrected reduced quantity. Within this setting, a positive reduced gap becomes spectrally meaningful only when exact sector resolution, finite-rank restriction, and complement closure are imposed in the proper order. The resulting construction is proposed as a methodological and operator-theoretic benchmark for Yang–Millsrelated mass-gap settings, without identifying the model with four-dimensional Yang–Mills theory itself.
- 26 March 2026
- Published by Springer Nature in Quantum Studies: Mathematics and Foundations
- Vol. 13 (2) , 18
Spectral–topological downfolding of quantum Hamiltonians: from matrix mechanics to effective spin models
- 26 March 2026
- Published by Springer Nature in Quantum Studies: Mathematics and Foundations
- Vol. 13 (2) , 18
Spectral–topological downfolding of quantum Hamiltonians: from matrix mechanics to effective spin models
- Open Access
- 19 March 2026
- Published by Elsevier in SSRN Electronic Journal
Tensorial Geometry of Orbital Reordering in Heavy Atoms
Reduced tensorial description is developed for heavy atoms in regimes of unstable orbital assignment.An effective metric is induced on a reduced electronic manifold from an isolated finite-rank sector of a self-adjoint operator family. Levi-Civita connection and curvature objects then follow without further postulate. Spectral terminology is used strictly in the operator sense. The classifier resolves domains where relativistic contraction, sector competition, and loss of orbital-label rigidity become coupled. Application to Au, Hg, Tl, and Pb yields a closed expression, controlled asymptotics, and chemically interpretable ordering tied to 6s-sector contraction.
- 19 March 2026
- Published by Elsevier in SSRN Electronic Journal
Open AccessTensorial Geometry of Orbital Reordering in Heavy Atoms
Reduced tensorial description is developed for heavy atoms in regimes of unstable orbital assignment.An effective metric is induced on a reduced electronic manifold from an isolated finite-rank sector of a self-adjoint operator family. Levi-Civita connection and curvature objects then follow without further postulate. Spectral terminology is used strictly in the operator sense. The classifier resolves domains where relativistic contraction, sector competition, and loss of orbital-label rigidity become coupled. Application to Au, Hg, Tl, and Pb yields a closed expression, controlled asymptotics, and chemically interpretable ordering tied to 6s-sector contraction.
- Open Access
- 13 March 2026
- Published by Elsevier in SSRN Electronic Journal
Electronic-State Assignment in Inorganic Chemistry
A practical criterion is proposed for deciding when familiar electronic assignments in inorganicchemistry remain reliable and when they become chemically fragile. The discussion is focused onsituations in which ligand substitution, coordination-geometry changes, oxidation-state variation,solvation, or spin–orbit effects bring competing electronic descriptions close in energy. In such cases, labels such as high-spin and low-spin, metal-centred and ligand-centred, or charge-transfer assignments may cease to be fully transferable across a chemical series. The framework is developed in inorganic terms and applied to representative cases including spin crossover in Fe(II) compounds, charge-transfer competition in coordination complexes, and relativistic effects in heavy-element chemistry. The main purpose is not to replace detailed electronic-structure calculations, but toprovide a compact inorganic language for distinguishing robust assignments from cases in which small chemical changes may alter state character, magnetic behaviour, redox accessibility, and reactivity.
- 13 March 2026
- Published by Elsevier in SSRN Electronic Journal
Open AccessElectronic-State Assignment in Inorganic Chemistry
A practical criterion is proposed for deciding when familiar electronic assignments in inorganicchemistry remain reliable and when they become chemically fragile. The discussion is focused onsituations in which ligand substitution, coordination-geometry changes, oxidation-state variation,solvation, or spin–orbit effects bring competing electronic descriptions close in energy. In such cases, labels such as high-spin and low-spin, metal-centred and ligand-centred, or charge-transfer assignments may cease to be fully transferable across a chemical series. The framework is developed in inorganic terms and applied to representative cases including spin crossover in Fe(II) compounds, charge-transfer competition in coordination complexes, and relativistic effects in heavy-element chemistry. The main purpose is not to replace detailed electronic-structure calculations, but toprovide a compact inorganic language for distinguishing robust assignments from cases in which small chemical changes may alter state character, magnetic behaviour, redox accessibility, and reactivity.
- Open Access
- 4 March 2026
- Published by Elsevier in SSRN Electronic Journal
The Physics of Spectral Change in Hermitian Families
A resolvent-compatible spectral–geometric diagnostic is introduced for parameter-dependent Hermitian families.The construction is based on principal angles between isolated spectral subspaces and defines a spectral–geometric mediation operator (SGMO) whose singular values satisfy the canonical tangent law sk = tan θk. This separates eigenvalue-branch motion from subspace rotation within a single resolvent-compatible framework. Reproducible 2 × 2 and 3×3 Hermitian benchmarks validate the construction, including anisotropic subspace response in clustered spectra. A two- arameter toy family H(λ, ρ) is used to illustrate channel-resolved geometric sensitivity at the operator level. The resulting HTT–SGMO layer provides a compact benchmark formalism for analyzing spectral corridors, where small gaps can produce amplified geometric reorganization even under modest spectral displacement.
- 4 March 2026
- Published by Elsevier in SSRN Electronic Journal
Open AccessThe Physics of Spectral Change in Hermitian Families
A resolvent-compatible spectral–geometric diagnostic is introduced for parameter-dependent Hermitian families.The construction is based on principal angles between isolated spectral subspaces and defines a spectral–geometric mediation operator (SGMO) whose singular values satisfy the canonical tangent law sk = tan θk. This separates eigenvalue-branch motion from subspace rotation within a single resolvent-compatible framework. Reproducible 2 × 2 and 3×3 Hermitian benchmarks validate the construction, including anisotropic subspace response in clustered spectra. A two- arameter toy family H(λ, ρ) is used to illustrate channel-resolved geometric sensitivity at the operator level. The resulting HTT–SGMO layer provides a compact benchmark formalism for analyzing spectral corridors, where small gaps can produce amplified geometric reorganization even under modest spectral displacement.
- Open Access
- 28 February 2026
- Published by Elsevier in SSRN Electronic Journal
A Relativistic Yukawa–Ligand-Field Variational Approach to Bonding in Coordination Complexes
A relativistic Yukawa–ligand-field variational (Y–LFVB) formalism for bonding is introduced by replacing parameter-only ligand-field descriptions with an operator-level, Yukawa-screened interaction potential with symmetry anisotropy and variational closure. The metal–ligand bond is defined operationally as a spectral minimum of an effective Hamiltonian, rather than via an imposed splitting parameter. Scalar-relativistic and spin–orbit terms enter as functionals of the adopted potential through Pauli/Foldy–Wouthuysen derivatives, so screening renormalizes spectrum and mixing. For square-planar (D4h) d8 complexes (Ni → Pd →Pt), a two-state σ-channel reduction yields an avoided-crossing corridor criterion, |∆| ≲ 2|t|, delimiting strong mixing and task switching.
- 28 February 2026
- Published by Elsevier in SSRN Electronic Journal
Open AccessA Relativistic Yukawa–Ligand-Field Variational Approach to Bonding in Coordination Complexes
A relativistic Yukawa–ligand-field variational (Y–LFVB) formalism for bonding is introduced by replacing parameter-only ligand-field descriptions with an operator-level, Yukawa-screened interaction potential with symmetry anisotropy and variational closure. The metal–ligand bond is defined operationally as a spectral minimum of an effective Hamiltonian, rather than via an imposed splitting parameter. Scalar-relativistic and spin–orbit terms enter as functionals of the adopted potential through Pauli/Foldy–Wouthuysen derivatives, so screening renormalizes spectrum and mixing. For square-planar (D4h) d8 complexes (Ni → Pd →Pt), a two-state σ-channel reduction yields an avoided-crossing corridor criterion, |∆| ≲ 2|t|, delimiting strong mixing and task switching.
- 5 February 2026
- Published by Elsevier in Chemical Physics Letters
- Vol. 888
Spectral origins of frontier-orbital inversions in atoms and molecules
- 5 February 2026
- Published by Elsevier in Chemical Physics Letters
- Vol. 888
Spectral origins of frontier-orbital inversions in atoms and molecules