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Journal of Chemical Theory and Computation|September 18, 2025
Understanding DFT Uncertainties for More Reliable Reactivity Predictions by Advancing the Analysis of Error SourcesGergely Laczkó, Imre Pápai, Péter R NagyJournal of Chemical Theory and Computation|July 27, 2018
Dual Basis Set Approach for Density Functional and Wave Function Embedding SchemesBence Hégely, Péter R Nagy, Mihály KállayGene Therapy|September 11, 2009
Therapeutic potential of genetically modified adult stem cells for osteopeniaS Kumar, T R Nagy, S PonnazhaganJournal of Chemical Theory and Computation|September 26, 2019
Reduced-Scaling Correlation Methods for the Excited States of Large Molecules: Implementation and Benchmarks for the Second-Order Algebraic-Diagrammatic Construction ApproachDávid Mester, Péter R Nagy, Mihály KállayJournal of Chemical Theory and Computation|August 29, 2024
Basis-Set Limit CCSD(T) Energies for Large Molecules with Local Natural Orbitals and Reduced-Scaling Basis-Set CorrectionsDávid Mester, Péter R Nagy, Mihály KállayInorganic Chemistry|October 5, 2022
Stability of Carbocyclic Phosphinyl Radicals: Effect of Ring Size, Delocalization, and StericsAnna Ott, Péter R Nagy, Zoltán BenkőJournal of Chemical Theory and Computation|September 13, 2016
An Integral-Direct Linear-Scaling Second-Order Møller-Plesset ApproachPéter R Nagy, Gyula Samu, Mihály KállayJournal of Chemical Theory and Computation|July 3, 2018
Optimization of the Linear-Scaling Local Natural Orbital CCSD(T) Method: Improved Algorithm and Benchmark ApplicationsPéter R Nagy, Gyula Samu, Mihály KállayJournal of Chemical Theory and Computation|September 29, 2025
Hybrid DFT Quality Thermochemistry and Environment Effects at GGA Cost via Local Quantum EmbeddingJózsef Csóka, Dénes Berta, Péter R NagyJournal of Bone and Mineral Research : the Official Journal of the American Society for Bone and Mineral Research|September 8, 2001
Validation of peripheral dual-energy X-ray absorptiometry for the measurement of bone mineral in intact and excised long bones of ratsT R Nagy, C W Prince, J LiPageof 23