Stabilizing and increasing the magnetic moment of half-metals: The role of Li in half-Heusler L Damewood, B Busemeyer, M Shaughnessy, CY Fong, LH Yang, ...
Physical Review B 91 (6), 064409, 2015
77 2015 From real materials to model hamiltonians with density matrix downfolding H Zheng, HJ Changlani, KT Williams, B Busemeyer, LK Wagner
Frontiers in Physics 6, 43, 2018
43 2018 Competing collinear magnetic structures in superconducting FeSe by first-principles quantum Monte Carlo calculations B Busemeyer, M Dagrada, S Sorella, M Casula, LK Wagner
Physical Review B 94 (3), 035108, 2016
43 2016 Excited states in variational Monte Carlo using a penalty method S Pathak, B Busemeyer, JNB Rodrigues, LK Wagner
The Journal of Chemical Physics 154 (3), 2021
30 2021 Accurate barrier heights using diffusion Monte Carlo K Krongchon, B Busemeyer, LK Wagner
The Journal of Chemical Physics 146 (12), 2017
23 2017 PyQMC: An all-Python real-space quantum Monte Carlo module in PySCF WA Wheeler, S Pathak, KG Kleiner, S Yuan, JNB Rodrigues, C Lorsung, ...
The Journal of Chemical Physics 158 (11), 2023
15 2023 Prediction for the singlet-triplet excitation energy for the spinel B Busemeyer, GJ MacDougall, LK Wagner
Physical Review B 99 (8), 081118, 2019
12 2019 Optical properties of defects in solids via quantum embedding with good active space orbitals BTG Lau, B Busemeyer, TC Berkelbach
The Journal of Physical Chemistry C 128 (7), 2959-2966, 2024
10 2024 Downfolding from ab initio to interacting model Hamiltonians: comprehensive analysis and benchmarking of the DFT+ cRPA approach Y Chang, EGCP van Loon, B Eskridge, B Busemeyer, MA Morales, ...
npj Computational Materials 10 (1), 129, 2024
7 2024 Spintronic properties and stability of the half-Heusler alloys LiMnZ (Z= N, P, Si) L Damewood, B Busemeyer, M Shaughnessy, CY Fong, LH Yang, ...
arXiv preprint arXiv:1301.6367, 2013
3 2013 Publisher's Note: Stabilizing and increasing the magnetic moment of half-metals: The role of Li in half-Heusler 91 , 064409 (2015)] L Damewood, B Busemeyer, M Shaughnessy, CY Fong, LH Yang, ...
Physical Review B 91 (9), 099901, 2015
2 2015 PyQMC: an all-Python real-space quantum Monte Carlo code W Wheeler, S Pathak, J Rodrigues, C Lorsung, Y Chang, Y Zhou, ...
APS March Meeting Abstracts 2021, E19. 009, 2021
1 2021 Insights into correlated electron systems from first-principles quantum Monte Carlo BM Busemeyer
University of Illinois at Urbana-Champaign, 2019
1 2019 Bonding, magnetic properties and stability of the half-Heusler alloys LiMnZ (Z= N, P, Si) L Damewood, B Busemeyer, M Shaughnessy, CY Fong, LH Yang, ...
Bulletin of the American Physical Society 58, 2013
1 2013 Downfolding from Ab Initio to Interacting Model Hamiltonians: Comprehensive Analysis and Benchmarking Y Chang, EGCP van Loon, B Eskridge, B Busemeyer, MA Morales, ...
arXiv e-prints, arXiv: 2311.05987, 2023
2023 Accurate Excitations of the NV-Defect in Diamond via Embedding with Auxilliary-Field Quantum Monte Carlo B Busemeyer, S Zhang
APS March Meeting Abstracts 2022, B67. 002, 2022
2022 Excitation Energies of Defects in Hexagonal Boron Nitride via an Embedding Method using Auxilliary-Field Quantum Monte Carlo B Busemeyer, S Zhang
APS March Meeting Abstracts 2021, F53. 007, 2021
2021 An approach to discovering the low-energy space for effective quantum models of realistic systems. B Busemeyer, J Rodrigues, S Pathak, L Wagner
Bulletin of the American Physical Society 65, 2020
2020 Prediction of the singlet-triplet excitation energy for the spinel, MgTi2 O4 via downfolding approach combined with first-principles Quantum Monte Carlo B Busemeyer, G MacDougall, L Wagner
APS March Meeting Abstracts 2019, V16. 009, 2019
2019 Effective models for the low energy behavior of FeSe from first principles quantum Monte Carlo B Busemeyer, L Wagner
APS March Meeting Abstracts 2018, E38. 013, 2018
2018 