Members‎ > ‎

Eric Isaacs

Eric Isaacs


Research Interests

Energy conversion (photovoltaic, photocatalytic, and thermoelectric) and storage (Li ion battery) materials, strongly correlated materials, first-principles electronic structure calculations.

Education

Publications

A materials informatics approach to the identification of one-band correlated materials analogous to the cuprates
E. B. Isaacs and C. Wolverton, arXiv:1806.09662

Performance of the strongly constrained and appropriately normed density functional for solid-state materials
E. B. Isaacs and C. Wolverton, Phys. Rev. Materials 2, 063801 (2018).

Inverse Band Structure Design via Materials Database Screening: Application to Square Planar Thermoelectrics
E. B. Isaacs and C. Wolverton, Chem. Mater. 30, 1540 (2018).

Compositional phase stability of strongly correlated electron materials within DFT+U
E. B. Isaacs and C. A. Marianetti, Phys. Rev. B 95, 045141 (2017).

Electronic correlations in monolayer VS2
E. B. Isaacs and C. A. Marianetti, Phys. Rev. B 94, 035120 (2016).

Adsorption Characteristics and Size/Shape Dependence of Pt Clusters on the CdS Surface
S. Xiong, E. B. Isaacs, and Y. Li, J. Phys. Chem. C 119, 4834 (2015).

Ideal strength and phonon instability of strained monolayer materials
E. B. Isaacs and C. A. Marianetti, Phys. Rev. B 89, 184111 (2014).

Relating Trends in First-Principles Electronic Structure and Open-Circuit Voltage in Organic Photovoltaics
E. B. Isaacs, S. Sharifzadeh, B. Ma, and J. B. Neaton, J. Phys. Chem. Lett. 2, 2531 (2011).