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Brenda M. Rubenstein - Publications

Affiliations: 
Brown University, Providence, RI 
Area:
Theoretical Chemistry
Website:
https://www.brown.edu/academics/chemistry/people/faculty/brenda-m-rubenstein
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21 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Shen T, Barghathi H, Yu J, Del Maestro A, Rubenstein BM. Stable recursive auxiliary field quantum Monte Carlo algorithm in the canonical ensemble: Applications to thermometry and the Hubbard model. Physical Review. E. 107: 055302. PMID 37329093 DOI: 10.1103/PhysRevE.107.055302  0.367
2021 Church MS, Rubenstein BM. Real-time dynamics of strongly correlated fermions using auxiliary field quantum Monte Carlo. The Journal of Chemical Physics. 154: 184103. PMID 34241020 DOI: 10.1063/5.0049116  0.641
2020 Shen T, Liu Y, Yu Y, Rubenstein BM. Finite temperature auxiliary field quantum Monte Carlo in the canonical ensemble. The Journal of Chemical Physics. 153: 204108. PMID 33261485 DOI: 10.1063/5.0026606  0.366
2020 Liu Y, Zhu GZ, Yuan DF, Qian CH, Zhang YR, Rubenstein BM, Wang LS. Observation of a Symmetry-Forbidden Excited Quadrupole-Bound State. Journal of the American Chemical Society. PMID 33185446 DOI: 10.1021/jacs.0c10552  0.382
2020 Yuan DF, Liu Y, Qian CH, Kocheril GS, Zhang YR, Rubenstein BM, Wang LS. Polarization of Valence Orbitals by the Intramolecular Electric Field from a Diffuse Dipole-Bound Electron. The Journal of Physical Chemistry Letters. 7914-7919. PMID 32898418 DOI: 10.1021/Acs.Jpclett.0C02514  0.504
2020 Yuan DF, Liu Y, Qian CH, Zhang YR, Rubenstein BM, Wang LS. Observation of a π-Type Dipole-Bound State in Molecular Anions. Physical Review Letters. 125: 073003. PMID 32857546 DOI: 10.1103/Physrevlett.125.073003  0.417
2020 Yang J, Naik N, Patel JS, Wylie CS, Gu W, Huang J, Ytreberg FM, Naik MT, Weinreich DM, Rubenstein BM. Predicting the viability of beta-lactamase: How folding and binding free energies correlate with beta-lactamase fitness. Plos One. 15: e0233509. PMID 32470971 DOI: 10.1371/Journal.Pone.0233509  0.303
2020 Liu Y, Shen T, Zhang H, Rubenstein B. Unveiling the Finite Temperature Physics of Hydrogen Chains via Auxiliary Field Quantum Monte Carlo. Journal of Chemical Theory and Computation. PMID 32456436 DOI: 10.1021/Acs.Jctc.0C00288  0.391
2020 Kent PRC, Annaberdiyev A, Benali A, Bennett MC, Landinez Borda EJ, Doak P, Hao H, Jordan KD, Krogel JT, Kylänpää I, Lee J, Luo Y, Malone FD, Melton CA, Mitas L, ... ... Rubenstein B, et al. QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo. The Journal of Chemical Physics. 152: 174105. PMID 32384844 DOI: 10.1063/5.0004860  0.472
2020 Cong R, Nanguneri R, Rubenstein B, Mitrovic VF. First principles calculations of the electric field gradient tensors of Ba2NaOsO6, a Mott insulator with strong spin orbit coupling. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 32369791 DOI: 10.1088/1361-648X/Ab9056  0.361
2020 Rosenstein JK, Dombroski A, Oakley K, Chen SL, Tann H, Rubenstein BM, Rose C, Reda S, Weber PM, Kim E, Sello J, Geiser J, Kennedy E, Arcadia C. Principles of Information Storage in Small-Molecule Mixtures. Ieee Transactions On Nanobioscience. PMID 32142450 DOI: 10.1109/Tnb.2020.2977304  0.31
2020 Hao H, Georges A, Millis AJ, Rubenstein B, Han Q, Shi H. Metal-insulator and magnetic phase diagram of Ca2RuO4 from auxiliary field quantum Monte Carlo and dynamical mean field theory Physical Review B. 101. DOI: 10.1103/Physrevb.101.235110  0.414
2019 Hao H, Rubenstein BM, Shi H. Auxiliary field quantum Monte Carlo for multiband Hubbard models: Controlling the sign and phase problems to capture Hund's physics Physical Review B. 99. DOI: 10.1103/Physrevb.99.235142  0.422
2018 Hao H, Shee J, Upadhyay S, Ataca C, Jordan KD, Rubenstein B. Accurate Predictions of Electron Binding Energies of Dipole-Bound Anions via Quantum Monte Carlo Methods. The Journal of Physical Chemistry Letters. PMID 30299101 DOI: 10.1021/Acs.Jpclett.8B02733  0.667
2018 Liu Y, Cho M, Rubenstein B. Ab Initio Finite Temperature Auxiliary Field Quantum Monte Carlo. Journal of Chemical Theory and Computation. PMID 30102856 DOI: 10.1021/Acs.Jctc.8B00569  0.449
2018 Kim J, Baczewski A, Beaudet T, Benali A, Bennett C, Berrill M, Blunt N, Borda EJL, Casula M, Ceperley D, Chiesa S, Clark BK, Clay R, Delaney K, Dewing M, ... ... Rubenstein B, et al. QMCPACK : An open source ab initio Quantum Monte Carlo package for the electronic structure of atoms, molecules, and solids. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 29582782 DOI: 10.1088/1361-648X/Aab9C3  0.677
2016 Chang C, Rubenstein BM, Morales MA. Auxiliary-field-based trial wave functions in quantum Monte Carlo calculations Physical Review B. 94. DOI: 10.1103/Physrevb.94.235144  0.368
2012 Rubenstein BM, Coluzza I, Miller MA. Controlling the folding and substrate-binding of proteins using polymer brushes. Physical Review Letters. 108: 208104. PMID 23003194 DOI: 10.1103/Physrevlett.108.208104  0.384
2012 Rubenstein BM, Zhang S, Reichman DR. Finite-temperature auxiliary-field quantum Monte Carlo technique for Bose-Fermi mixtures Physical Review a - Atomic, Molecular, and Optical Physics. 86. DOI: 10.1103/Physreva.86.053606  0.617
2010 Rubenstein BM, Gubernatis JE, Doll JD. Comparative Monte Carlo efficiency by Monte Carlo analysis. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 82: 036701. PMID 21230207 DOI: 10.1103/Physreve.82.036701  0.396
2008 Rubenstein BM, Kaufman LJ. The role of extracellular matrix in glioma invasion: a cellular Potts model approach. Biophysical Journal. 95: 5661-80. PMID 18835895 DOI: 10.1529/Biophysj.108.140624  0.522
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