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Norm M. Tubman, Ph.D. - Publications

Affiliations: 
2011 Physics and Astronomy Northwestern University, Evanston, IL 
Area:
Quantum Physics
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25 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 Williams-Young DB, Tubman NM, Mejuto-Zaera C, de Jong WA. A parallel, distributed memory implementation of the adaptive sampling configuration interaction method. The Journal of Chemical Physics. 158. PMID 37259999 DOI: 10.1063/5.0148650  0.327
2022 Bassman Oftelie L, Klymko K, Liu D, Tubman NM, de Jong WA. Computing Free Energies with Fluctuation Relations on Quantum Computers. Physical Review Letters. 129: 130603. PMID 36206437 DOI: 10.1103/PhysRevLett.129.130603  0.422
2022 Mejuto-Zaera C, Tzeli D, Williams-Young D, Tubman NM, Matoušek M, Brabec J, Veis L, Xantheas SS, de Jong WA. The Effect of Geometry, Spin, and Orbital Optimization in Achieving Accurate, Correlated Results for Iron-Sulfur Cubanes. Journal of Chemical Theory and Computation. PMID 35034448 DOI: 10.1021/acs.jctc.1c00830  0.319
2021 Kremenetski V, Mejuto-Zaera C, Cotton SJ, Tubman NM. Simulation of adiabatic quantum computing for molecular ground states. The Journal of Chemical Physics. 155: 234106. PMID 34937349 DOI: 10.1063/5.0060124  0.447
2021 Epifanovsky E, Gilbert ATB, Feng X, Lee J, Mao Y, Mardirossian N, Pokhilko P, White AF, Coons MP, Dempwolff AL, Gan Z, Hait D, Horn PR, Jacobson LD, Kaliman I, ... ... Tubman NM, et al. Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package. The Journal of Chemical Physics. 155: 084801. PMID 34470363 DOI: 10.1063/5.0055522  0.567
2021 Mejuto-Zaera C, Weng G, Romanova M, Cotton SJ, Whaley KB, Tubman NM, Vlček V. Are multi-quasiparticle interactions important in molecular ionization? The Journal of Chemical Physics. 154: 121101. PMID 33810679 DOI: 10.1063/5.0044060  0.591
2020 Eriksen JJ, Anderson TA, Deustua JE, Ghanem K, Hait D, Hoffmann MR, Lee S, Levine DS, Magoulas I, Shen J, Tubman NM, Whaley KB, Xu E, Yao Y, Zhang N, et al. The Ground State Electronic Energy of Benzene. The Journal of Physical Chemistry Letters. 8922-8929. PMID 33022176 DOI: 10.1021/acs.jpclett.0c02621  0.564
2020 Tubman NM, Freeman CD, Levine DS, Hait D, Head-Gordon M, Whaley KB. Modern Approaches to Exact Diagonalization and Selected Configuration Interaction with the Adaptive Sampling CI Method. Journal of Chemical Theory and Computation. PMID 32159951 DOI: 10.1021/Acs.Jctc.8B00536  0.592
2020 Levine DS, Hait D, Tubman NM, Lehtola S, Whaley KB, Head-Gordon M. CASSCF with Extremely Large Active Spaces using the Adaptive Sampling Configuration Interaction Method. Journal of Chemical Theory and Computation. PMID 32109055 DOI: 10.1021/Acs.Jctc.9B01255  0.541
2020 Mejuto-Zaera C, Zepeda-Núñez L, Lindsey M, Tubman N, Whaley B, Lin L. Efficient hybridization fitting for dynamical mean-field theory via semi-definite relaxation Physical Review B. 101. DOI: 10.1103/Physrevb.101.035143  0.387
2019 Hait D, Tubman NM, Levine DS, Whaley KB, Head-Gordon M. What levels of coupled cluster theory are appropriate for transition metal systems? A study using near exact quantum chemical values for 3d transition metal binary compounds. Journal of Chemical Theory and Computation. PMID 31465217 DOI: 10.1021/Acs.Jctc.9B00674  0.536
2019 Mejuto-Zaera C, Tubman NM, Whaley KB. Dynamical mean field theory simulations with the adaptive sampling configuration interaction method Physical Review B. 100. DOI: 10.1103/Physrevb.100.125165  0.653
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, ... ... Tubman N, 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  0.461
2017 Lehtola S, Tubman NM, Whaley KB, Head-Gordon M. Cluster decomposition of full configuration interaction wave functions: A tool for chemical interpretation of systems with strong correlation. The Journal of Chemical Physics. 147: 154105. PMID 29055342 DOI: 10.1063/1.4996044  0.585
2016 Tubman NM, Lee J, Takeshita TY, Head-Gordon M, Whaley KB. A deterministic alternative to the full configuration interaction quantum Monte Carlo method. The Journal of Chemical Physics. 145: 044112. PMID 27475353 DOI: 10.1063/1.4955109  0.674
2016 Holmes A, Tubman N, Umrigar CJ. Heat-bath Configuration Interaction: An efficient selected CI algorithm inspired by heat-bath sampling. Journal of Chemical Theory and Computation. PMID 27428771 DOI: 10.1021/Acs.Jctc.6B00407  0.384
2016 Holzmann M, Clay RC, Morales MA, Tubman NM, Ceperley DM, Pierleoni C. Theory of finite size effects for electronic quantum Monte Carlo calculations of liquids and solids Physical Review B. 94. DOI: 10.1103/Physrevb.94.035126  0.666
2015 Yang Y, Kylänpää I, Tubman NM, Krogel JT, Hammes-Schiffer S, Ceperley DM. How large are nonadiabatic effects in atomic and diatomic systems? The Journal of Chemical Physics. 143: 124308. PMID 26429012 DOI: 10.1063/1.4931667  0.632
2015 Tubman NM, Liberatore E, Pierleoni C, Holzmann M, Ceperley DM. Molecular-Atomic Transition along the Deuterium Hugoniot Curve with Coupled Electron-Ion Monte Carlo Simulations. Physical Review Letters. 115: 045301. PMID 26252690 DOI: 10.1103/Physrevlett.115.045301  0.642
2014 Tubman NM, Yang DC. Calculating the entanglement spectrum in quantum Monte Carlo with application to ab initio Hamiltonians Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.081116  0.531
2014 Tubman NM, Kylänpää I, Hammes-Schiffer S, Ceperley DM. Beyond the Born-Oppenheimer approximation with quantum Monte Carlo methods Physical Review a - Atomic, Molecular, and Optical Physics. 90. DOI: 10.1103/Physreva.90.042507  0.682
2013 Swingle B, Mcminis J, Tubman NM. Oscillating terms in the Renyi entropy of Fermi gases and liquids Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.235112  0.437
2013 McMinis J, Tubman NM. Renyi entropy of the interacting Fermi liquid Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.081108  0.36
2012 Tubman NM, DuBois JL, Alder BJ. Recent results in the exact treatment of fermions at zero and finite temperature Acs Symposium Series. 1094: 41-50. DOI: 10.1021/bk-2012-1094.ch004  0.593
2011 Tubman NM, DuBois JL, Hood RQ, Alder BJ. Prospects for release-node quantum Monte Carlo. The Journal of Chemical Physics. 135: 184109. PMID 22088054 DOI: 10.1063/1.3659143  0.737
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