Discover open access scientific publications

Search, annotate, share and cite publications

Publications by Gustavo E. Scuseria

Intensive Atomization Energy: Re-Thinking a Metric for Electronic Structure Theory Methods

Zeitschrift fur Physikalische Chemie
Theoretical ChemistryPhysical
2016English

Structural Phase Transitions of the Metal Oxide Perovskites SrTiO3, LaAlO3, and LaTiO3studied With a Screened Hybrid Functional

Physical Review B
2013English

Sign Problem in Full Configuration Interaction Quantum Monte Carlo: Linear and Sublinear Representation Regimes for the Exact Wave Function

Physical Review B
2014English

Observing Metal-Catalyzed Chemical Reactions in Situ Using Surface-Enhanced Raman Spectroscopy on Pd−Au Nanoshells

Journal of the American Chemical Society
BiochemistryColloidCatalysisChemistrySurface Chemistry
2008English

Evaluation of Range-Separated Hybrid Density Functionals for the Prediction of Vibrational Frequencies, Infrared Intensities, and Raman Activities

Physical Chemistry Chemical Physics
Theoretical ChemistryAstronomyPhysicsPhysical
2008English

Assessment of the Perdew–Burke–Ernzerhof Exchange-Correlation Functional

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
1999English

Efficient Hybrid Density Functional Calculations in Solids: Assessment of the Heyd–Scuseria–Ernzerhof Screened Coulomb Hybrid Functional

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2004English

Hartree–Fock Orbitals Significantly Improve the Reaction Barrier Heights Predicted by Semilocal Density Functionals

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2008English

Amanote Research

Note-taking for researchers

Follow Amanote

© 2025 Amaplex Software S.P.R.L. All rights reserved.

Privacy PolicyRefund Policy