Synthical
Your space
Profile
Activity
Favorites
Folders
Feeds
All articles
Claim page
Lucas K. Wagner
Follow
Activity
Upvotes
Folders
Articles
47
Capturing spin fluctuations in CaCuO
_2
:
\textit{Ab initio}
QMC calculations with multi-determinant wave functions
7 September 2024 by
Chun Chow
and
others
Strongly Correlated Electrons
Downfolding from Ab Initio to Interacting Model Hamiltonians: Comprehensive Analysis and Benchmarking of the DFT+cRPA Approach
8 July 2024 by
Yueqing Chang
and
others
Strongly Correlated Electrons
Particle-hole asymmetric phases in doped twisted bilayer graphene
5 March 2024 by
Run Hou
and
others
Strongly Correlated Electrons
Ensemble variational Monte Carlo for optimization of correlated excited state wave functions
1 December 2023 by
William Wheeler
and
others
Computational Physics
Learning emergent models from
\textit{ab initio}
many-body calculations
14 November 2023 by
Yueqing Chang
and
others
Strongly Correlated Electrons
,
Materials Science
Registry-dependent potential energy and lattice corrugation of twisted bilayer graphene from quantum Monte Carlo
12 November 2023 by
Kittithat Krongchon
and
others
at
University of Illinois at Urbana-Champaign
Mesoscale and Nanoscale Physics
,
Materials Science
PyQMC: an all-Python real-space quantum Monte Carlo module in PySCF
2 December 2022 by
William Wheeler
and
others
Materials Science
,
Chemical Physics
Quantification of electron correlation for approximate quantum calculations
5 August 2022 by
Shunyue Yuan
and
others
Chemical Physics
Revisiting the Dark Matter Interpretation of Excess Rates in Semiconductors
14 February 2022 by
Peter Abbamonte
and
others
High Energy Physics
,
Cosmology and Nongalactic Astrophysics
Excited states in variational Monte Carlo using a penalty method
14 October 2021 by
Shivesh Pathak
and
others
Chemical Physics
,
Materials Science
An accurate tight binding model for twisted bilayer graphene describes topological flat bands without geometric relaxation
7 October 2021 by
Shivesh Pathak
and
others
Mesoscale and Nanoscale Physics
,
Strongly Correlated Electrons
Electric field effects on the band gap and edge states of monolayer 1T'-WTe2
19 November 2020 by
Yulia Maximenko
and
others
Mesoscale and Nanoscale Physics
,
Materials Science
Recent developments in the PySCF program package
11 July 2020 by
Qiming Sun
and
others
Chemical Physics
,
Computational Physics
Combining Density Functional Theories to Correctly Describe the Energy, Lattice Structure and Electronic Density of Functional Oxide Perovskites
8 May 2020 by
Kiel Williams
and
others
at
Griffith University
Theory
Combining density functional theories to correctly describe the energy, lattice structure and electronic density of functional oxide perovskites
7 May 2020 by
Kiel Williams
and
others
Materials Science
,
Other Condensed Matter
A light weight regularization for wave function parameter gradients in quantum Monte Carlo
22 February 2020 by
Shivesh Pathak
and
Lucas Wagner
Computational Physics
,
Materials Science
Charge-spin susceptibility as a useful probe of electronic correlations in quantum materials
13 January 2020 by
J. N. B. Rodrigues
and
Lucas Wagner
Superconductivity
Direct comparison of many-body methods for realistic electronic Hamiltonians
5 October 2019 by
Kiel Williams
and
others
Materials Science
,
Strongly Correlated Electrons
Many-Body Electric Multipole Operators in Extended Systems
30 September 2019 by
William Wheeler
and
others
Strongly Correlated Electrons
Prediction for the singlet-triplet excitation energy for the spinel MgTi
_2
O
_4
using first-principles diffusion Monte Carlo
2 November 2018 by
Brian Busemeyer
and
others
Strongly Correlated Electrons
Effective spin-orbit models using correlated first-principles wave functions
11 September 2018 by
Yueqing Chang
and
Lucas Wagner
Materials Science
Non-orthogonal determinants in multi-Slater-Jastrow trial wave functions for fixed-node diffusion Monte Carlo
20 August 2018 by
Shivesh Pathak
and
Lucas Wagner
Materials Science
,
Chemical Physics
Uncovering anisotropic magnetic phases via fast dimensionality analysis
23 May 2018 by
Manohar Karigerasi
and
others
Materials Science
From real materials to model Hamiltonians with density matrix downfolding
1 December 2017 by
Huihuo Zheng
and
others
Strongly Correlated Electrons
,
Materials Science
Quantum Monte Carlo study of the metal to insulator transition on a honeycomb lattice with 1/r interactions
1 September 2017 by
Li Chen
and
Lucas Wagner
Strongly Correlated Electrons
Computation of the unifying thread in high temperature superconductors from first principles quantum Monte Carlo
2 May 2017 by
Awadhesh Narayan
and
others
Superconductivity
The importance of sigma bonding electrons for the accurate description of electron correlation in graphene
4 January 2017 by
Huihuo Zheng
and
others
Materials Science
Accurate barrier heights using diffusion Monte Carlo
23 November 2016 by
Kittithat Krongchon
and
others
Chemical Physics
Computational and experimental investigation of unreported transition metal selenides and sulphides
2 May 2016 by
Awadhesh Narayan
and
others
Materials Science
,
Strongly Correlated Electrons
Competing collinear magnetic structures in superconducting FeSe by first principles quantum Monte Carlo calculations
5 February 2016 by
Brian Busemeyer
and
others
Superconductivity
Load more
This is an AI-generated summary
Key points
Topics
Materials Science
Strongly Correlated Electrons
Chemical Physics
Computational Physics
Superconductivity
Mesoscale and Nanoscale Physics
Other Condensed Matter
High Energy Physics
Mathematical Physics
Cosmology and Nongalactic Astrophysics
Theory
Atomic and Molecular Clusters