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Dan Thomas Major

Bar Ilan University

50H-index
238Paper Count
9.1KCitation Count
Published Papers 134
Publication Date
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Mechanistic Insights into Self-Limiting Si–F CEI Formation via a Molecularly Designed Sacrificial Additive
errEnergy Storage Materials
IF20.2
err2026-04-09
err0
PREAI
errMamta Sham Lal; Robin Kumar; Devendra Yadav; Khorsed Alam; Yogendra Kumar; Akanksha Joshi; Arun Krishnan; Tal Shalom; Yuri Mikhlin; Hagit Aviv; Dmitry Bravo‐Zhivotovskii; Yitzhak Apeloig; Dan Thomas Major; Malachi Noked
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RxnNet: An AI Framework for Reaction Mechanism Discovery─A Case Study of Carbocations
errJournal of Chemical Theory and Computation
IF5.5
err2026-03-08
err0
PREAI
errShani Zev; Michal Roth; Jishnu Narayanan S J; Dan T. Major
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A methionine-lined active site governs carbocation stabilization and product specificity in a bacterial terpene synthase
errFEBS Letters
IF3
err2026-03-01
err0
errOAAI
errRingel, Marion; Helmer, Carl P. O.; Zev, Shani; Driller, Ronja; Buhr, Emily; Reinbold, Markus; Schwartz, Renana; Foley, Gabriel; Boden, Mikael; Garbe, Daniel; Schenk, Gerhard; Major, Dan Thomas; Loll, Bernhard; Bruck, Thomas
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Restraint Quality, Not Quantity, Predicts Peptide-Protein Docking Outcomes
errJournal of Chemical Information and Modeling
IF5.3
err2026-01-01
err1
PREAI
errGulman, Miriam; Chill, Jordan; Major, Dan Thomas
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Layered Ti1-xFexS2 Cathode Materials with Anionic Redox Chemistry for Mg Storage
errADVANCED ENERGY AND SUSTAINABILITY RESEARCH
IF5.7
err2025-12-01
err0
errOAAI
errChakraborty, Arup; Wang, Haoxiang; Yan, Kaijie; Xu, Zinuo; Lin, Zejing; Wang, Chengliang; Suo, Liumin; Mao, Minglei; Major, Dan T.
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Mitigating Structural Degradation in O3-Layered Sodium-Ion Cathodes: Insights from Mg Doping in NaNi0.2Fe0.4Mn0.4O2
errAdvanced Energy Materials
IF26
err2025-11-29
err0
errOAAI
errAkanksha Joshi; Amreen Bano; Sandipan Maiti; Arun Krishnan; Aleksandr Kondrakov; Shubham Patel; Roman R. Kapaev; Tatiana K. Zakharchenko; Nicole Leifer; Dan Thomas Major; Doron Aurbach; Malachi Noked
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Predicting Electrolyte Redox Potential Trends through Long-Range Electrostatics and Configuration Ensembles: Insights from MD and QM/MM Simulations
errJournal of Chemical Theory and Computation
IF5.5
err2025-11-24
err0
PREAI
errKhorsed Alam; Shubham Patel; Amreen Bano; Langyuan Wu; Netanel Shpigel; Dan T. Major
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Tuning Interphase Composition in Sodium-Ion Batteries via Co-Solvent Selection and Anion-Driven Solvation Shell Engineering
errSmall Methods
IF9.1
err2025-11-12
err0
PREAI
errHarshita Lohani; Amreen Bano; Arpita Ghosh; Ajit Kumar; Dhruv Kumar; Pratima Kumari; Dan Thomas Major; Sagar Mitra
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The initial dynamics of product release in terpene synthases—The case of CotB2
errProtein Science
IF5.2
err2025-09-24
err0
errOAAI
errPrashant Kumar Gupta; Carl P. O. Helmer; Marion Ringel; Bernhard Loll; Thomas Brück; Dan Thomas Major
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Covalency modulation in Co-free high entropy cathodes for enhanced stability and performance in sodium-ion batteries
errmaterials today advances
IF22
err2025-08-13
err0
PREAI
errAkanksha Joshi; Mia Ramos; Sri Harsha Akella; Khorsed Alam; Roman R. Kapaev; Sankalpita Chakrabarty; Nicole Leifer; Ananya Maddegalla; Yuri Mikhlin; Doron Aurbach; Dan Thomas Major; Malachi Noked
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errSave
LixSiyOz coating for LiCoO2 cathode material using atomic layer deposition (ALD)
errJournal of Solid State Electrochemistry
IF2.6
err2025-08-06
err0
errOAAI
errOrly Aminov; Amreen Bano; Ortal Shalev; Moriah Perry; Dan T. Major; Malachi Noked
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errSave
Doping Strategies in Ni-Rich NCM Cathode Materials for Next-Generation Li-Ion Batteries: A Systematic Computational Study
errACS Applied Energy Materials
IF5.5
err2025-07-17
err0
PREAI
errArup Chakraborty; Amreen Bano; Sooraj Kunnikuruvan; Boris Markovsky; Doron Aurbach; Dan Thomas Major
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errSave
Multidopant Induced Entropy Effect on TiS2/TiSe2-Based Layered Anode and Formation of Electrode–Electrolyte Interphase
errBatteries & Supercaps
IF4.7
err2025-07-14
err0
PREAI
errAmreen Bano; Dan T. Major
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errSave
Theoretical Study on High-Entropy Oxyfluoride Cathodes for Sodium-Ion Batteries
errACS APPLIED ENERGY MATERIALS
IF5.5
err2025-04-28
err0
PREAI
errAlam, K; Joshi, A; Bano, A; Noked, M; Major, DT
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CHARMM-GUI EnzyDocker for Protein-Ligand Docking of Multiple Reactive States along a Reaction Coordinate in Enzymes
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-02-14
err1
errOAAI
errSuh, Donghyuk; Schwartz, Renana; Gupta, Prashant Kumar; Zev, Shani; Major, Dan T.; Im, Wonpil
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errSave
Enhancing High-Voltage LNMO Cathode Performance in Li-Metal Batteries Via Anionic Electrolyte Additive-Integrated CEI Engineering
errADVANCED FUNCTIONAL MATERIALS
IF19
err2024-11-14
err0
errOAAI
errAhuja, Aakash; Kumar, Ajit; Alam, Khorsed; Lohani, Harshita; Sengupta, Abhinanda; Kumari, Pratima; Thapliyal, Kritika; Major, Dan T.; Mitra, Sagar
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How Can the Diterpene Synthase CotB2V80L Alter the Product Profile?
errCHEMCATCHEM
IF3.9
err2024-09-12
err1
errOAAI
errHimpich, Stephanie; Ringel, Marion; Schwartz, Renana; Dimos, Nicole; Driller, Ronja; Helmer, Carl P. O.; Gupta, Prashant Kumar; Haack, Martina; Major, Dan Thomas; Brueck, Thomas; Loll, Bernhard
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Fluorinated Co-Solvents Enable Excellent Performances of Practical Cells Comprising LixSiO-Graphite Composite Anodes and LiNi0.89Co0.05Mn0.05Al0.01O2 (NCMA) Cathodes
errSMALL
IF12.1
err2024-06-25
err1
PREAI
errVangapally, Naresh; Lusztig, David; Rathod, Suman; Bano, Amreen; Scalar, Hadar; Akella, Sri Harsha; Noked, Malachi; Major, Dan. T.; Halalay, Ion C.; Sriramulu, Suresh; Luski, Shalom; Aurbach, Doron
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Self-discharge in flowless Zn-Br2 batteries and its mitigation
errENERGY STORAGE MATERIALS
IF20.2
err2024-06-01
err2
PREAI
errBallas, Elad; Nimkar, Amey; Bergman, Gil; Elazari, Ran; Wakshlak, Racheli; Sharon, Daniel; Levi, Mikhael D.; Major, Dan Thomas; Mandler, Daniel; Shpigel, Netanel; Aurbach, Doron
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Inclusion of Anion Additives in the Inner Solvation Shell to Regulate the Composition of Solid Electrolyte Interphase
errADVANCED ENERGY MATERIALS
IF26
err2024-05-28
err3
PREAI
errLohani, Harshita; Kumar, Ajit; Bano, Amreen; Ghosh, Arpita; Kumari, Pratima; Ahuja, Aakash; Sengupta, Abhinanda; Kumar, Dhruv; Major, Dan Thomas; Mitra, Sagar
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Research Directions

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Co-authors
Cooperation Journals
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Khalil Amine
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Y
Yang‐Kook Sun
H-index: 164 · Papers: 1.2K
L
Linda F. Nazar
H-index: 132 · Papers: 461
C
Clare P. Grey
H-index: 132 · Papers: 1.2K
K
Kenneth A. Jacobson
H-index: 117 · Papers: 1.3K
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