QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo PRC Kent, A Annaberdiyev, A Benali, MC Bennett, EJ Landinez Borda, ...
The Journal of Chemical Physics 152 (17), 174105, 2020
141 2020 A new generation of effective core potentials for correlated calculations MC Bennett, CA Melton, A Annaberdiyev, G Wang, L Shulenburger, ...
The Journal of Chemical Physics 147 (22), 224106, 2017
130 2017 A new generation of effective core potentials from correlated calculations: 3d transition metal series A Annaberdiyev, G Wang, CA Melton, MC Bennett, L Shulenburger, ...
The Journal of Chemical Physics 149 (13), 134108, 2018
92 2018 A new generation of effective core potentials from correlated calculations: 2nd row elements MC Bennett, G Wang, A Annaberdiyev, CA Melton, L Shulenburger, ...
The Journal of Chemical Physics 149 (10), 104108, 2018
72 2018 A new generation of effective core potentials from correlated calculations: 4s and 4p main group elements and first row additions G Wang, A Annaberdiyev, CA Melton, MC Bennett, L Shulenburger, ...
The Journal of Chemical Physics 151 (14), 2019
59 2019 Accurate atomic correlation and total energies for correlation consistent effective core potentials A Annaberdiyev, CA Melton, MC Bennett, G Wang, L Mitas
Journal of Chemical Theory and Computation 16 (3), 1482-1502, 2020
24 2020 Cohesion and excitations of diamond-structure silicon by quantum Monte Carlo: Benchmarks and control of systematic biases A Annaberdiyev, G Wang, CA Melton, MC Bennett, L Mitas
Physical Review B 103 (20), 205206, 2021
23 2021 A new generation of effective core potentials from correlated and spin–orbit calculations: Selected heavy elements G Wang, B Kincaid, H Zhou, A Annaberdiyev, MC Bennett, JT Krogel, ...
The Journal of Chemical Physics 157 (5), 2022
14 2022 Binding and excitations in SixHy molecular systems using quantum Monte Carlo G Wang, A Annaberdiyev, L Mitas
The Journal of Chemical Physics 153 (14), 2020
11 2020 The role of electron correlations in the electronic structure of putative Chern magnet TbMn6 Sn6 A Annaberdiyev, S Mandal, L Mitas, JT Krogel, P Ganesh
npj Quantum Materials 8 (1), 50, 2023
5 2023 Electronic structure of A Annaberdiyev, CA Melton, G Wang, L Mitas
Physical Review B 106 (7), 075127, 2022
5 2022 Assessing the accuracy of compound formation energies with quantum Monte Carlo EB Isaacs, H Shin, A Annaberdiyev, C Wolverton, L Mitas, A Benali, ...
Physical Review B 105 (22), 224110, 2022
5 2022 Weighted nodal domain averages of eigenstates for quantum Monte Carlo and beyond L Mitas, A Annaberdiyev
Chemical Physics 557, 111483, 2022
4 2022 Emergent Magnetism with Continuous Control in the Ultrahigh-Conductivity Layered Oxide PdCoO2 M Brahlek, AR Mazza, A Annaberdiyev, M Chilcote, G Rimal, GB Halász, ...
Nano Letters 23 (16), 7279-7287, 2023
3 2023 A new generation of effective core potentials: Selected lanthanides and heavy elements H Zhou, B Kincaid, G Wang, A Annaberdiyev, P Ganesh, L Mitas
The Journal of Chemical Physics 160 (8), 2024
2 2024 A quantum Monte Carlo study of systems with effective core potentials and node nonlinearities H Zhou, A Scemama, G Wang, A Annaberdiyev, B Kincaid, M Caffarel, ...
Chemical Physics 554, 111402, 2022
2 2022 Enhanced Twist-Averaging Technique for Magnetic Metals: Applications Using Quantum Monte Carlo A Annaberdiyev, P Ganesh, JT Krogel
Journal of Chemical Theory and Computation 20 (7), 2786-2797, 2024
2024 Achieving Reliable Quantum Monte Carlo Predictions in Si Systems Using Correlation Consistent Effective Core Potentials A Annaberdiyev
North Carolina State University, 2021
2021 
Lubos MitasDistinguished University Professor, North Carolina State UniversityПодтвержден адрес электронной почты в домене ncsu.edu
