Jaron T. Krogel

Jaron T Krogel

Research Staff

Contact

KROGELJT@ORNL.GOV

All Publications

Toward improved property prediction of 2D materials using many-body quantum Monte Carlo methods
Identifying Band Inversions in Topological Materials Using Diffusion Monte Carlo...
Stacking polymorphism of PtSe2: its implication to layer-dependent metal-insulator transitions...
Diffusion Quantum Monte Carlo Benchmarking of Magnetic Moments in MnBi2Te4
Quantum Monte Carlo and Density Functional Theory Study of Strain and Magnetism in 2D 1T-VSe2 with Charge Density Wave States...
Quantum Monte Carlo and Density Functional Theory Study of Strain and Magnetism in 2D 1T-VSe2 with Charge Density Wave States
Software stewardship and advancement of a high-performance computing scientific application: QMCPACK
Force-Free Identification of Minimum-Energy Pathways and Transition States for Stochastic Electronic Structure Theories...
Putting error bars on density functional theory
Exploring interlayer coupling in the twisted bilayer PtTe2
Enhancing MnBi2Te4 Stability by Doping
JARVIS-Leaderboard: a large scale benchmark of materials design methods
Enhanced Twist-Averaging Technique for Magnetic Metals: Applications Using Quantum Monte Carlo
Software engineering to sustain a high-performance computing scientific application: QMCPACK
DFT+U and quantum Monte Carlo study of electronic and optical properties of AgNiO2 and AgNi1−xCoxO2 delafossite
Predictions of delafossite-hosted honeycomb and kagome phases
Stacking Faults and Topological Properties in MnBi2Te4: Reconciling Gapped and Gapless States
The role of electron correlations in the electronic structure of putative Chern magnet TbMn6Sn6...
Evaluation of the excitation spectra with diffusion Monte Carlo on an auxiliary bosonic ground state...
Structural Stability of Graphene-Supported Pt Layers: Diffusion Monte Carlo and Density Functional Theory Calculations
Emergent Magnetism with Continuous Control in the Ultrahigh-Conductivity Layered Oxide PdCoO2
Procedures for Assessing the Stability of Proposed Topological Materials
Existence of La-site antisite defects in LaMO3 (M=Mn, Fe, and Co) predicted with many-body diffusion quantum Monte Carlo
A Quantum Monte Carlo Study of the Structural, Energetic, and Magnetic Properties of Two-Dimensional H and T Phase VSe 2
Existence of La-site antisite defects in LaMO3(M=Mn, Fe, and Co) predicted with many-body diffusion quantum Monte Carlo

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