Prof. Eran Rabani

School of Chemistry
ביה"ס לכימיה סגל אקדמי בכיר
Prof. Eran Rabani
Phone: 03-6407599
Fax: 03-6407042
Office: Ornstein - Chemistry, 219

About Eran Rabani

Eran Rabani is a leading researcher in the field of theoretical and computational chemistry, specializing in the study of nanomaterials and their interactions. He has made significant contributions to the development of stochastic-orbital techniques, reducing the computational complexity of calculating ground and excited state properties of materials. His work has also advanced our understanding of excited state dynamics, particularly in nanocrystals and quantum dots, with applications to photoluminescence, exciton dynamics, and charge transfer. Rabani's research integrates advanced computational methods, with the goal of developing atomistic models and exploring novel ways to control their properties. His work is at the forefront of nanoscience, combining fundamental theory with practical applications in material science.

Curriculum Vitae

Education:

Ph.D., Theoretical Chemistry, The Hebrew University, 1996,
Thesis Topic: Dynamics and Kinetics of Molecular Rydberg States: A Dynamic and Dissipative Approach

B.Sc. (summa cum laude), Special Program "Amirim", The Hebrew University, 1991,
Thesis Topic: "Kinetics and Dynamics of Ion-Dipole Reaction" (with distinction)

 


Academic Positions:

Glenn T. Seaborg Chair in Physical Chemistry, University of California, Berkeley, 2017 - present
Faculty Scientist, Lawrence Berkeley National Laboratory, Berkeley, 2015 - present
Professor, Department of Chemistry, University of California, Berkeley, 2014 - present
Professor, School of Chemistry, Tel Aviv University, 2008 - present
The Marko & Lucie Chaoul Chair for Theoretical and Computational Nanoscience, Tel Aviv University, 2013 - 2015
Visiting Miller Research Professor, University of California, Berkeley, 2010 - 2011
Associate Professor, School of Chemistry, Tel Aviv University, 2003 - 2008
Senior Lecturer, School of Chemistry, Tel Aviv University, 1993 - 2003
Post-Doctoral Research Scientist, Columbia University, 1996 - 1999
Teaching Assistant, The Hebrew University, 1991 - 1996

 


Academic Administration:

Director, The Sackler Center for Computational Molecular and Materials Science, Tel Aviv University, 2015 - present
Associate Editor, Nano Letters, American Chemical Society, 2015 - 2021
Vice President for Research and Development, Tel Aviv University, 2012
Chair, Department of Chemical Physics, Tel Aviv University, 2006 - 2010
Director, The Sackler Institute for Chemical Physics, Tel Aviv University, 2006 - 2010
Director, Undergraduate Chemistry Program, 2006 - 2009

 


Prizes and Honors:

International Association of Advanced Materials Fellow, 2023
Humboldt Research Award, 2022
Vebleo Fellow for Prominence and Leadership in the Field of Science, 2021
Glenn T. Seaborg Chair in Physical Chemistry, University of California, Berkeley, 2017
Baker Symposium Speaker, Cornell University, 2016
Kavli Frontiers of Science Alumni, 2015
Marko & Lucie Chaoul Chair for Theoretical and Computational Nanoscience, Tel Aviv University, 2013
Visiting Miller Research Professor, University of California, Berkeley 2010
Marie Curie International Outgoing Fellow, 2010 - 2013
J.T. Oden Faculty Fellow, University of Texas, Austin 2009
Invited Professorship, Ecole Normale Superieure, Paris 2008 - 2009
The Michael Bruno memorial award, Yad Hanadiv, 2006
ICS Prize for Excellent Young Chemists, Israel Chemical Society, 2003
The Friedenberg Foundation Award, Israel Science Foundation, 2002
The Bergmann Memorial Research Award, United States-Israel Binational Science Foundation, 2000
The Yigal Alon Fellowship, The Israeli Council of Higher Education, 1999 - 2002
The Fulbright Postdoctoral Fellowship, 1997
The Rothschild Postdoctoral Fellowship, Yad Hanadiv, 1996
The Charles Clore Fellowship For Outstanding Scholars in the Natural Sciences, 1993 - 1996
The Rector's Award, The Hebrew University, 1992
The Patai Award, The Hebrew University, 1991
The Dean's List of Outstanding Scholars, The Hebrew University, 1989 - 1991
The Dean's Award, The Hebrew University, 1989
The Elving Award, The Hebrew University, 1989

 

Research grants:

2024-2025: NSF Center Integration of Modern Optoelectronic Materials on Demand ($80,000) 

2022-2025: Department of Energy, Fundamentals of Semiconductor Nanowire ($510,000)

2021-2025: Department of Energy, Discovery through Advanced Computing - SciDAC ($720,000)

2021-2024: National Science Foundation ($375,000)
2019-2022: Department of Energy, Physical Chemistry of Inorganic Nanostructures ($525,000)
2018-2022: Energy Frontier Research Centers, Photonics at Thermodynamic Limits ($670,000)
2017-2020: UC Laboratory Fees Research Program Competition, Mesoscopic 2D materials: Many-body interactions and applications ($270,000)
2016-2019: Department of Energy, Physical Chemistry of Inorganic Nanostructures ($325,000)
2016-2020: Department of Energy, Center for Computational Materials Science ($700,000)
2016-2019: National Science Foundation - DMREF ($333,333)
2015-2018: National Science Foundation ($450,000)
2015-2017: Laboratory Directed Research and Development (LDRD) ($213,000)
2014-2017: BSF-NSF International Collaboration in Chemistry ($210,000)
2014-2017: Israel Science Foundation - FIRST program ($134,500)
2013-2017: Israel Science Foundation - Alternative Fuels for Transportation ($170,000)
2011-2015: Israel Science Foundation ($222,000)
2010-2013: Marie Curie FP7-PEOPLE-IOF (€ 337,094)
2009-2013: United States-Israel Binational Science Foundation ($92,000)
2008-2012: Israel science Foundation ($60,000)
2007-2010: Converging Technologies - Israel science Foundation ($82,500)
2007-2011: Israel Science Foundation ($184,000)
2007-2008: Department of Defense - AFRL ($25,000)
2006-2009: Ministry of Science (180,000 NIS)
2006-2007: Minerva-Gentner Symposia (€ 65,000)
2005-2008: Sixth Framework Programme NMP - Specific Targeted Research Project - SA-NANO (€ 182,216)
2003-2007: United States-Israel Binational Science Foundation ($120,000)
2002-2006: Israel Science Foundation ($200,000)
2002-2006: The Wolfson Center of Excellence ($1,500,000 Chemical Physics Group)
2000-2003: United States-Israel Binational Science Foundation ($71,000)
2000-2002: Israel Science Foundation ($52,000+$100,000 Equipment)

 


Voluntary Activity:

Board Member, Telluride Research Science Center, Telluride Colorado, 2012 - 2017
Vice Mayor, Har Adar, Israel, 2008 - 2010
Council Member, Har Adar, Israel, 2008 - 2010
Chair, Education Committee, Har Adar, Israel, 2008 - 2010
Chair, Board of Elementary School, Har Adar, Israel, 2005 - 2007

Research Interests

Optoelectronic Properties of Nanomaterials

The quantum confinement effect in nanoscale crystals unlocks size-tunable optical and electronic properties, affording numerous applications in biological sensing, renewable energy, and frontier devices. Theoretical approaches to understand and control the numerous exciting properties of nanocrystals (NCs) are limited by the challenge of accurately computing quantum systems of many thousands of atoms.

We develop models using stochastic electronic structure methods, semi-empirical pseudopotentials, and classical force fields to accurately describe the exciton fine structure, phonon modes, and exciton-phonon couplings of NCs. We are examining these systems in collaboration with experimentalists to understand the nature of charge carriers, fundamental photophysics, and quantum effects at the nanoscale.

 

Quasiparticle Dynamics

Electron transfer is the essential process that gives life energy, enables modern technology, and characterizes the structure of matter. We are interested in studying the diverse electron transfer properties in nanomaterials. Our methods may serve as a starting point for studying electron transport properties in QD arrays for quantum information processors or layers in photo-harvesting devices. 

We are eager to take our expertise into regimes where traditional techniques are not adequate. Current efforts especially focus on how the interplay of lattice vibrations, light, and electrons affect the dynamics in complicated and experimentally relevant low dimensional materials. Our models aim to capture and explain dynamic optical and electronic phenomena for such strongly-coupled systems.

 

Stochastic Electronic Structure Methods

​Understanding the fundamental physics and chemistry of molecules and materials requires high-level simulations of their geometry, electronic structure, and dynamics. However, the steep computational cost of modern quantum chemistry methods makes it challenging to perform simulations of systems relevant to current experiments and technological applications.

To tackle this problem, we have developed stochastic approaches to traditional methods in quantum chemistry that rely on cheaper stochastic estimations of the physical observables at the cost of introducing a small controllable error. This has led to the first-ever report of a sub-linear scaling electronic structure method. These developments allow us to compute ground-state and excited-state properties of molecules, nanostructures, and materials.

Publications (2019-2024)

Complete and updated list can be found here

D. Chabeda, S. Gee and E. Rabani. Ligand Induced Size-Dependent Circular Dichroism in Quantum Dots.  J. Phys. Chem. Lett. 15, 7863-7869 (2024).

R. E. Hadad, A. Roy, E. Rabani, R. Redmer, and R. Baer. Stochastic Density Functional Theory Combined with Langevin Dynamics for Warm Dense Matter.  Phys. Rev. E 109, 065304 (2024).

​Y. Shen, K. Klymko, E. Rabani, D. Camps, R. Van Beeumen, and M. Lindsey. Efficient Quantum Trace Estimation with Reconfigurable Real-Time Circuits.  (2024).

​C. L. Bassani, G. van Anders, U. Banin, D. Baranov, Q. Chen, M. Dijkstra, M. S. Dimitriyev, E. Efrati, J. Faraudo, O. Gang, N. Gaston, R. Golestanian, G. I. Guerrero-Garcia, M. Gruenwald, A. Haji-Akbari, M. Ibanez, M. Karg, T. Kraus, B. Lee, R. C. Van Lehn, R. J. Macfarlane, B. M. Mognetti, A. Nikoubashman, S. Osat, O. V. Prezhdo, G. M. Rotskoff, L. Saiz, A.-C. Shi, S. Skrabalak, I. I. Smalyukh, M. Tagliazucchi, D. V. Talapin, A. V. Tkachenko, S. Tretiak, D. Vaknin, A. Widmer-Cooper, G. C. L. Wong, X. Ye, S.  Zhou, E. Rabani, M. Engel, and A. Travesset. Nanocrystal Assemblies: Current Advances and Open Problems. ACS Nano 18, 14791-14840 (2024).

​A. Levi, B. Hou, O. Alon, Y. Ossia, L. Verbitsky, S. Remennik, E. Rabani, and U.  Banin. The Effect of Monomer Size on Fusion and Coupling in Colloidal Quantum Dot Molecules. Nano Lett. 23, 11307–11313 (2023).

​K. Peng and E. Rabani.  Polaritonic Bottleneck in Colloidal Quantum Dots.  Nano Lett. 23, 10587-10593 (2023).

​A. M. Oddo, M. Gao, D. Weinberg, J. Jin, M. C. Folgueras, C. Song, C. Ophus, T. Mani, E. Rabani, and P. Yang. Energy Funneling in a Non-Integer Two-Dimensional Perovskite. Nano Lett. 23, 11469-11476 (2023).

​A. Gupta, J. C. Ondry, K. Lin, Y. Chen, M. H. Hudson, M. Chen, R. D. Schaller, A. J. Rossini, E. Rabani, and D. V. Talapin. Composition-defined Optical Properties and the Direct to Indirect Transition in Core-Shell In1-xGaxP/ZnS Colloidal Quantum Dots.  J. Am. Chem. Soc. 145, 16429-16448  (2023).

​H. L. Weaver, C. M. Went, J. Wong, D. Jasrasaria, E. Rabani, H. A. Atwater, and N. S. Ginsberg. Detecting, Distinguishing, and Spatiotemporally Tracking Photogenerated Charge and Heat at the Nanoscale. ACS Nano 17, 19011-19021 (2023).

​L. Mejia, J. Yin, D. R. Reichman, R. Baer, C. Yang, and E. Rabani. Stochastic Real-Time Second-Order Green's Function Theory for Neutral Excitations in Molecules and Nanostructures. J. Chem. Theory Comput.  19, 5563−5571 (2023).

​D. Weinberg, Y. Park, D. T. Limmer, and E. Rabani. Size-Dependent Lattice Symmetry Breaking Determines the Exciton Fine Structure of Perovskite Nanocrystals. Nano Lett. 23, 4997–5003 (2023).

​D. Jasrasaria and E. Rabani. Circumventing the Phonon Bottleneck by Multiphonon-Mediated Hot Exciton Cooling at the Nanoscale. Npj Comput. Mater. 9, 145 (2023).

​G. R. Bowman, S. J. Cox, C. Dellago, K. H. DuBay, J. D. Eaves, D. A. Fletcher, L. B. Frechette, M. Grünwald, K. Klymko, J. Ku, A. Omar, E. Rabani, D. R. Reichman, J. R. Rogers, A. M. Rosnik, G. M. Rotskoff, A. R. Schneider, N. Schwierz, D. A. Sivak, S. Vaikuntanathan, S. Whitelam, and A. Widmer-Cooper. Remembering the Work of Phillip L. Geissler: A Coda to His Scientific Trajectory. Ann. Rev. Phys. Chem. 74, 1-27 (2023).


K. Lin, D. Jasrasaria, J. J. Yoo, M. Bawendi, H. Utzat, and E. Rabani. Theory of Photoluminescence Spectral Line Shapes of Semiconductor Nanocrystals. J. Phys. Chem. Lett. 14, 7241-7248 (2023).

B. Hou, M. Thoss, U. Banin, and E. Rabani. Incoherent Nonadiabatic to Coherent Adiabatic Transition of Electron Transfer in Colloidal Quantum Dot Molecules. Nature Commun. 14, 3073 (2023).

​V. Blum, R. Asahi, J. Autschbach, C. Bannwarth, G. Bihlmayer, S. Blugel, L. A. Burns, T. D. Crawford, W. Dawson, W. A. de Jong, C. Draxl, C. Filippi, L. Genovese, P. Giannozzi, N. Govind, S. Hammes-Schiffer , J. R. Hammond, B. Hourahine , A. Jain, Y. Kanai, P. R. C. Kent, A. H. Larsen, S. Lehtola, X. Li , R. Lindh, S. Maeda , N. Makri , J. Moussa, T. Nakajima, J. A. Nash, M. J. T. Oliveira, P. D. Patel, G. Pizzi , G. Pourtois, B. P. Pritchard, E. Rabani, M. Reiher, L. Reining, X. Ren, M. Rossi, H. B. Schlegel, N. Seriani, L V. Slipchenko, A. J. W. Thom, E. F. Valeev, B. Van Troeye, L. Visscher, V. Vlcek, H.-J. Werner, D. B. Williams-Young, T. L. Windus.  Roadmap on Software for Electronic Structure Based Simulations in Chemistry and Materials. Electron. Struct. (2024).

​M. Chen, R. Baer, and E. Rabani. Structure Optimization with Stochastic Density Functional Theory. J. Chem. Phys. 158, 024111 (2023).

E. Rabani and D. R. Reichman. In Memory of Phillip L. Geissler (1974-2022). Nano Lett. 22, 6847-6848 (2022).

L. Verbitsky, D. Jasrasaria, U. Banin, and E. Rabani. Hybridization and Deconfinement in Colloidal Quantum Dot Molecules. J. Chem. Phys. 157, 134502 (2022).

P. R. Wrona, E. Rabani, and P. L. Geissler. A Pair of 2D Quantum Liquids: Investigating the Phase Behavior of Indirect Excitons. ACS Nano 16, 15339-15346 (2022).

S. Z. Uddin, N. Higashitarumizu, D. Weinberg, N. Sefidmooye Azar, I. K. M. Reaz Rahman, K. B. Crozier, E. Rabani, and A. Javey. Anomalous Thickness Dependence of Photoluminescence Quantum Yield in Black Phosphorous. Nature Nanotech., 1-7, (2023).

​P. Brosseau, J. Geuchies, D. Jasrasaria, A. Houtepen, E. Rabani, and P. Kambhampati. Ultrafast Hole Relaxation Channels in Quantum Dots Revealed by Two-Dimensional Electronic Spectroscopy.  Commun. Phys. 6, 48 (2023).

​D. Jasrasaria, D. Weinberg, J. P. Philbin, and E. Rabani. Perspective: Simulations of Nonradiative Processes in Semiconductor Nanocrystals. J. Chem. Phys. 157, 020901 (2022). Erratum.
 

W. Dou, J. Lee, J. Zhu, L. Mejia, D. R. Reichman, R. Baer, and E. Rabani. Time Dependent Second Order Green's Function Theory for Neutral Excitations. J. Chem. Theory Comput. 18, 5221-5232 (2022).

A. Das, G. Krishnan, E. Rabani, and U. Harbola. Tagged Particle Dynamics in Supercooled Quantum Liquids. Phys. Rev. E 105, 054136 (2022).

N. Higashitarumizu, S. Z. Uddin, H. Kim, E. Rabani, and A. Javey. Engineering Exciton Recombination Pathways in Bilayer WSe2 for Bright Luminescence. ACS Nano 16, 1339-1345 (2022).

M. Enright, D. Jasrasaria, M. Hanchard, D. Needell, M. Phelan, D. Weinberg, B. McDowell, H.-W. Hsiao, H. Akbari, M. Kottwitz, M. Potter, J. Wong, J.-M. Zuo, H. Atwater, E. Rabani, and R. Nuzzo. Role of Atomic Structure on Exciton Dynamics and Photoluminescence in NIR Emissive InAs/InP/ZnSe Quantum Dots. J. Phys. Chem. C 126, 7576-7587 (2022).

R. Baer, D. Neuhauser, and E. Rabani. Stochastic Vector Techniques in Ground-State Electronic Structure. Ann. Rev. Phys. Chem. 73, 12.1-12.18 (2022).

B. Shpiro, M. Fabian, E. Rabani, and R. Baer. Forces From Stochastic Density Functional Theory Under Nonorthogonal Atom-Centered Basis Sets. J. Chem. Theory Comput. 18, 1458-1466 (2022).

N. Ng and E. Rabani. Long-time Memory Effects in a Localizable Central Spin Problem. New J. Phys. 24, 013025 (2022).

W. Li, V. Vlcek, H. Eisenberg, E. Rabani, R. Baer, and D. Neuhauser. Tuning the Range Separation Parameter in Periodic Systems. arXiv:2102.11041 , (2021).

J. P. Philbin, J. Kelly, L. Peng, I. Coropceanu, A. Hazarika, D. V. Talapin, E. Rabani, X. Ma, and P. Narang. Room Temperature Single-Photon Super Fluorescence From a Single Epitaxial Cuboid Nano-Heterostructure. arXiv:2104.06452 , (2021).

N. Ng, D. T. Limmer, and E. Rabani. Nonuniqueness of Generalized Quantum Master Equations for a Single Observable. J. Chem. Phys 155, 156101 (2021).

D. Jasrasaria and E. Rabani. Interplay of Surface and Interior Modes in Exciton-Phonon Coupling at the Nanoscale. Nano Lett. 21, 8741-8948 (2021). Erratum.
 

M. Nguyen, W. Li, Y. Li, R. Baer, E. Rabani, and D. Neuhauser. Tempering Stochastic Density Functional Theory. J. Chem. Phys. 155, 204105 (2021).

H. Kim, S. Z. Uddin, N. Higashitarumizu, E. Rabani, and A. Javey. Inhibited Nonradiative Decay at All Exciton Densities in Monolayer Semiconductors. Science 373, 448-452 (2021).

A. Das, E. Rabani, K. Miyazaki, and U. Harbola. Frequency-Dependent Specific Heat in Quantum Supercooled Liquids: A Mode-Coupling Study. J. Chem. Phys. 154, 164512 (2021).

M. Chen, D. Neuhauser, R. Baer, and E. Rabani. Stochastic Density Functional Theory: Real- and Energy-Space Fragmentation for Noise Reduction. J. Chem. Phys. 154, 204108 (2021).

N. Ng, S. Wenderoth, R. R. Seelam, E. Rabani, H.-D. Meyer, M. Thoss,and M. Kolodrubetz. Localization Dynamics in a Centrally Coupled System. Phys. Rev. B 103, 134201 (2021).

A. Levy, E. Rabani, and D. T. Limmer. Response Theory for Nonequilibrium Steady-States of Open Quantum Systems. Phys. Rev. Res. 3, 023252 (2021).

C. Yan, D. Weinberg, D. Jasrasaria, M. A. Kolaczkowski, Z.-j. Liu, J. P. Philbin, A. D. Balan, Y. Liu, A. M. Schwartzberg, E. Rabani, and A. P. Alivisatos. Uncovering the Role of Hole Traps in Promoting Hole Transfer from Multi-Excitonic Quantum Dots to Molecular Acceptors. ACS Nano 15, 2281-2291 (2021).

A. Das, E. Rabani, K. Miyazaki, and U. Harbola. Structural Relaxation in Quantum Supercooled Liquids: A Mode-Coupling Approach. J. Chem. Phys. 154, 014502 (2021).

S. Z. Uddin, E. Rabani, and A. Javey. Universal Inverse Scaling of Exciton-Exciton Annihilation Coefficient with Exciton Lifetime. Nano Lett. 21, 424-429 (2021).

N. C. Bradbury, C. Chuang, A. P. Deshmukh, E. Rabani, R. Baer, J. R. Caram, and D. Neuhauser. Stochastically Realized Observables for Excitonic Molecular Aggregates. J. Phys. Chem. A 124, 10111-10120 (2020).

J. Ondry, J. P. Philbin, M. Lostica, E. Rabani, and A. P. Alivisatos. Colloidal Synthesis Path to 2D Crystalline Quantum Dot Superlattices. ACS Nano 15, 2251-2262 (2021).

B. Guzelturk, B. L. Cotts, D. Jasrasaria, J. P. Philbin, D. A. Hanifi, B. A. Koscher, A. D. Balan, E. Curling, M. Zajac, S. Park, N. Yazdani, C. Nyby, V. Kamysbayev, S. Fischer, Z. Nett, X. Shen, M. E. Kozina, M.-F. Lin, A. H. Reid, S. P. Weathersby, R. D. Schaller, V. Wood, X. Wang, J. A. Dionne, D. V. Talapin, A. P. Alivisatos, A. Salleo, E. Rabani, A. M. Lindenberg. Dynamic Lattice Distortions Driven by Surface Trapping in Semiconductor Nanocrystals. Nature Commun. 12, 1860 (2021).

D. Jasrasaria, J. P. Philbin, C. Yan, D. Weinberg, A. P. Alivisatos, and E. Rabani. Sub-bandgap Photoinduced Transient Absorption Features in CdSe Nanostructures: The Role of Trapped Holes. J. Phys. Chem. C 124, 17372-17378 (2020).

W. Dou, M. Chen, T. Y. Takeshita, M. Chen, R. Baer, D. Neuhauser, and E. Rabani. Range-Separated Stochastic Resolution of Identity: Formulation and Application to Second Order Green's Function Theory. J. Chem. Phys. 153, 074113 (2020).

J. P. Philbin, A. Brumberg, B. T. Diroll, W. Cho, D. V. Talapin, R. D. Schaller, and E. Rabani. Area and Thickness Dependence of Auger Recombination in Nanoplatelets. J. Chem. Phys. 153, 054104 (2020).

J. P. Philbin and E. Rabani. Auger Recombination Lifetime Scaling for Type-I and Quasi-Type-II Core/Shell Quantum Dots. J. Phys. Chem. Lett. 11, 5132-5138 (2020).

B. Ji, E. Rabani, Al. L. Efros, R. Vaxenburg, O. Ashkenazy, D. Azulay, U. Banin, and O. Millo. Dielectric Confinement and Excitonic Effects in Two-Dimensional Nanoplatelets. ACS Nano 14, 8257-8265 (2020).

A. J. Lee, M. Chen, W. Li, D. Neuhauser, R. Baer, and E. Rabani. Dopant Levels in Large Nanocrystals Using Stochastic Optimally Tuned Range-Separated Hybrid Density Functional Theory. Phys. Rev. B 102, 035112 (2020).

E. Arnon, E. Rabani, D. Neuhauser, and R. Baer. Efficient Langevin Dynamics for "Noise" Forces. J. Chem. Phys. 152, 161103 (2020).

X. Zhang, G. Lum R. Baer, E. Rabani, D. Neuhauser. Linear-Response Time-Dependent Density Functional Theory With Stochastic Range-eparated Hybrids. J. Chem. Theory Comput. 16, 1064-1072 (2020).

W. Dou, T. Y. Takeshita, M. Chen, R. Baer, D. Neuhauser, and E. Rabani. Stochastic Resolution of Identity for Real-Time Second-Order Green's Function: Ionization Potential and Quasi-particle Spectrum. J. Chem. Theory Comput. 15, 6703-6711 (2019).

M. Chen, D. Neuhauser, R. Baer, and E. Rabani. Energy Window Stochastic Density Functional Theory. J. Chem. Phys. 151, 114116 (2019).

Y. Cytter, E. Rabani, D. Neuhauser, R. Redmer, and R. Baer. Transition to Metallization in Warm Dense Helium-Hydrogen Mixtures Using Stochastic Density Functional Theory Within the Kubo-Greenwood Formalism. Phys. Rev. B 100, 195101 (2019).

W. Li, M. Chen, E. Rabani, R. Baer, and D. Neuhauser. Stochastic Embedding DFT: Theory and Application to P-Nitroaniline in Water. J. Chem. Phys. 151, 174115 (2019).

T. Y. Takeshita, W. Dou, D. G. A. Smith, W. A. de Jong, R. Baer, D. Neuhauser, and E. Rabani. Stochastic Resolution of Identity Second-Order Matsubara Green's Function Theory. J. Chem. Phys. 151, 044114 (2019).

J. Ondry, J. P. Philbin, M. Lostica, E. Rabani, and A. P. Alivisatos. Resilient Pathways to Atomic Attachment of Quantum Dot Dimers and Artificial Solids from Faceted CdSe Quantum Dot Building Blocks. ACS Nano 13, 12322-12344 (2019).

A. Levy, W. Dou, E. Rabani, and D. T. Limmer. A Complete Quasiclassical Map for the Dynamics of Interacting Fermions. J. Chem. Phys. 150, 234112 (2019).

A. Hazarika, I. Fedin, L. Hong, J. Guo, V. Srivastava, W. Cho, I. Coropceanu, J. Portner, B. T. Diroll, J. P. Philbin, E. Rabani, R. Klie, D. V. Talapin. Colloidal Atomic Layer Deposition with Stationary Reactant Phases Enables Precise Synthesis of Digital Nano-heterostructures. J. Am. Chem. Soc. 141, 13487-13496 (2019).

A. Brumberg, S. M. Harvey, J. P. Philbin, B. T. Diroll, B. Lee, S. A. Crooker, M. R. Wasielewski, E. Rabani, and R. D. Schaller. Determination of the In-Plane Exciton Radius in 2D CdSe Nanoplatelets via Magneto-Optical Spectroscopy. ACS Nano 13, 8589-8596 (2019).

A. Levy, L. Kidon, J. Batge, J. Okamoto, M. Thoss, D. T. Limmer, and E. Rabani. Absence of Coulomb Blockade in the Anderson Impurity Model at the Symmetric Point. J. Phys. Chem. C 123, 13538-13544 (2019).

V. Vlcek, E. Rabani, R. Baer, and D. Neuhauser. Nonmonotonic Band Gap Evolution in Bent Phosphorene Nanosheets. Phys. Rev. Mater. 3, 064601 (2019).

M. Chen, D. Neuhauser, R. Baer, and E. Rabani. Overlapped Embedded Fragment Stochastic Density Functional Theory for Covalently Bonded Materials. J. Chem. Phys. 150, 034106 (2019).

M. Fabian, B. Shpiro, E. Rabani, D. Neuhauser, and R. Baer. Stochastic Density Functional Theory. WIREs Comput. Mol. Sci. e1412, 1-15 (2019).
 

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