2026 Mark S. Hybertsen: Materials Science Researcher – H-Index, Publications & Awards

Discipline name	D-Index	World Ranking	Current World Ranking	National Ranking	Current National Ranking	Publications	Citations
Materials Science	85	2120	2046	629	590	317	41747

Research.com Recognitions

2001 - Fellow of American Physical Society (APS) Citation For fundamental developments in the theory of electronic and optical properties of materials, especially the importance of manybody effects, and the application to semiconductor optoelectronic technology

Overview

Mark S. Hybertsen is affiliated with Brookhaven National Laboratory in the United States. Their research primarily spans the fields of Materials Science and Engineering, with subfields including Materials Chemistry, Electrical and Electronic Engineering, Atomic and Molecular Physics and Optics, Renewable Energy, Sustainability and the Environment, and Computational Theory and Mathematics.

The scientist's work covers multiple specialized topics, notably:

Machine Learning in Materials Science
Computational Drug Discovery Methods
X-ray Diffraction in Crystallography
Chalcogenide Semiconductor Thin Films
Electronic and Structural Properties of Oxides
Electrocatalysts for Energy Conversion
Advanced Photocatalysis Techniques

Mark S. Hybertsen has contributed to numerous publications across various venues. The most frequent publication venues include:

Physical Review Materials
arXiv (Cornell University)
Communications Materials
Angewandte Chemie International Edition
Journal of the American Chemical Society

Notable recent publications are:

A Physical Model for Understanding the Activation of MoS ₂ Basal-Plane Sulfur Atoms for the Hydrogen Evolution Reaction, 2020, Angewandte Chemie International Edition
Microscopic relaxation channels in materials for superconducting qubits, 2021, Communications Materials
Formation and Evolution of Metallocene Single-Molecule Circuits with Direct Gold-π Links, 2022, Journal of the American Chemical Society
Uncertainty-aware predictions of molecular x-ray absorption spectra using neural network ensembles, 2023, Physical Review Research
Resolving the Evolution of Atomic Layer-Deposited Thin-Film Growth by Continuous In Situ X-Ray Absorption Spectroscopy, 2021, Chemistry of Materials

Over the course of their career, Mark S. Hybertsen has collaborated frequently with several coauthors, including:

Deyu Lu
Xiaohui Qu
Eli Stavitski
Fanchen Meng
Matthew R. Carbone

Among the awards received is the designation as a Fellow of the American Physical Society (APS) in 2001, recognizing fundamental developments in the theory of electronic and optical properties of materials, with emphasis on many-body effects and semiconductor optoelectronic technology applications.

Best Publications

Electron correlation in semiconductors and insulators: Band gaps and quasiparticle energies.

Mark S. Hybertsen;Steven G. Louie

4556
Citations
Exciton Binding Energy and Nonhydrogenic Rydberg Series in Monolayer WS 2

Alexey Chernikov;Timothy C. Berkelbach;Heather M. Hill;Albert Rigosi

2686
Citations
Colloquium : Excitons in atomically thin transition metal dichalcogenides

Gang Wang;Alexey Chernikov;Mikhail M. Glazov;Tony F. Heinz

1959
Citations
Dependence of single-molecule junction conductance on molecular conformation

Latha Venkataraman;Jennifer E. Klare;Colin Nuckolls;Mark S. Hybertsen

1736
Citations
First-principles theory of quasiparticles: Calculation of band gaps in semiconductors and insulators.

Mark S. Hybertsen;Steven G. Louie

1642
Citations
Theory of neutral and charged excitons in monolayer transition metal dichalcogenides

Timothy C. Berkelbach;Mark S. Hybertsen;David R. Reichman

1082
Citations
Single-Molecule Circuits with Well-Defined Molecular Conductance

Latha Venkataraman;Jennifer E. Klare;Iris W. Tam;Colin Nuckolls

1048
Citations
Renormalization of Molecular Electronic Levels at Metal-Molecule Interfaces

Jeffrey B. Neaton;Mark S. Hybertsen;Steven G. Louie;Steven G. Louie

1020
Citations
Graphene Oxidation: Thickness-Dependent Etching and Strong Chemical Doping

Li Liu;Sunmin Ryu;Michelle R. Tomasik;Elena Stolyarova

1016
Citations
Visualizing individual nitrogen dopants in monolayer graphene.

Liuyan Zhao;Rui He;Kwang Taeg Rim;Theanne Schiros

1000
Citations
Calculation of Coulomb-interaction parameters for La 2 CuO 4 using a constrained-density-functional approach

Mark S. Hybertsen;Michael Schlüter;Niels E. Christensen

867
Citations
Mechanically controlled binary conductance switching of a single-molecule junction.

Su Ying Quek;Maria Kamenetska;Michael L. Steigerwald;Hyoung Joon Choi

797
Citations
High-resolution scanning tunneling microscopy imaging of mesoscopic graphene sheets on an insulating surface

Elena Stolyarova;Kwang Taeg Rim;Sunmin Ryu;Janina Maultzsch

769
Citations
Observation of biexcitons in monolayer WSe2

Yumeng You;Yumeng You;Xiao-Xiao Zhang;Timothy C. Berkelbach;Mark S. Hybertsen

736
Citations
Absorption and emission of light in nanoscale silicon structures.

Mark S. Hybertsen

618
Citations
Amine-gold linked single-molecule circuits: experiment and theory.

Su Ying Quek;Latha Venkataraman;Hyoung Joon Choi;Steven G. Louie

605
Citations
Connecting dopant bond type with electronic structure in N-doped graphene.

Theanne Schiros;Dennis Nordlund;Lucia Pálová;Deborah Prezzi

585
Citations
Renormalization from density-functional theory to strong-coupling models for electronic states in Cu-O materials

Mark S. Hybertsen;E. B. Stechel;M. Schluter;D. R. Jennison

577
Citations
Amine-Gold Linked Single-Molecule Junctions: Experiment and Theory

Su Ying Quek;Latha Venkataraman;Hyoung Joon Choi;Steven G. Louie

545
Citations
Ab initio static dielectric matrices from the density-functional approach. I. Formulation and application to semiconductors and insulators.

Mark S. Hybertsen;Steven G. Louie

502
Citations
Contact Chemistry and Single-Molecule Conductance : A Comparison of Phosphines, Methyl Sulfides, and Amines

Young S Park;Adam C Whalley;Maria Kamenetska;Michael L Steigerwald

460
Citations