Daniel Wines

National Institute of Standards and Technology

United States

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Articles (18)

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2025

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2021

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2020

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2020

Collaborators (4)

Kamal Choudhary

National Institute of Standards and Technology

UNITED STATES

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Can Ataca

Assistant Professor

University of Maryland Baltimore County

UNITED STATES

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Trevor David Rhone

Professor

UNITED STATES

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Pascal Friederich

Juniorprofessor

Karlsruhe Institute of Technology

GERMANY

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Daniel Wines

Research Interests

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Articles (18)

Toward improved property prediction of 2D materials using many-body quantum Monte Carlo methods

CHIPS-FF: Evaluating Universal Machine Learning Force Fields for Material Properties

Quantum Monte Carlo and Density Functional Theory Study of Strain and Magnetism in 2D 1T-VSe2 with Charge Density Wave States

Hybrid-LLM-GNN: integrating large language models and graph neural networks for enhanced materials property prediction

Data-driven design of high pressure hydride superconductors using DFT and deep learning

JARVIS-Leaderboard: a large scale benchmark of materials design methods

Modeling Chemical Exfoliation of Non-van der Waals Chromium Sulfides by Machine Learning Interatomic Potentials and Monte Carlo Simulations

Inverse Design of Next-Generation Superconductors Using Data-Driven Deep Generative Models

Systematic DFT+U and Quantum Monte Carlo Benchmark of Magnetic Two-Dimensional (2D) CrX3 (X = I, Br, Cl, F)

A Quantum Monte Carlo Study of the Structural, Energetic, and Magnetic Properties of Two-Dimensional H and T Phase VSe2

High-Throughput DFT-Based Discovery of Next Generation Two-Dimensional (2D) Superconductors

Recent progress in the JARVIS infrastructure for next-generation data-driven materials design

Intrinsic Ferromagnetism of Two-Dimensional (2D) MnO2 Revisited: A Many-Body Quantum Monte Carlo and DFT+U Study

A pathway toward high-throughput quantum Monte Carlo simulations for alloys: A case study of two-dimensional (2D) GaSxSe1−x

Abnormal Phase Transition and Band Renormalization of Guanidinium-Based Organic–Inorganic Hybrid Perovskite

Positive and Negative Photoconductivity in Monolayer MoS2 as a Function of Physisorbed Oxygen

Engineering the Electronic, Thermoelectric, and Excitonic Properties of Two-Dimensional Group-III Nitrides through Alloying for Optoelectronic Devices (B1–xAlxN, Al1–xGaxN, and Ga1–xInxN)

A first-principles Quantum Monte Carlo study of two-dimensional (2D) GaSe

Collaborators (4)

Kamal Choudhary

Can Ataca

Trevor David Rhone

Pascal Friederich

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