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M

Madarasz, Adam

research centre for natural sciences

0H-index
1Paper Count
0Citation Count
Published Papers 26
Publication Date
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Dielectric properties of disordered crystalline materials: a computational case study on hexagonal ice
errnpj Computational Materials
IF11.9
err2026-02-17
err0
errOAAI
errZahra Tohidi Nafe; Ádám Madarász
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PredPotS: web tool for predicting one-electron standard reduction potentials for organic molecules in aqueous phase
errnpj Computational Materials
IF11.9
err2025-12-07
err0
errOAAI
errFlóra B. Németh; Andrea Hamza; Beatrix Tugyi; Maya El-Ali; Luca Szegletes; Ádám Madarász; Imre Pápai
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Application of Deconvolution in Path Integral Simulations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-10-15
err0
errOAAI
errMadarasz, Adam; Laczko, Gergely
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2-in-1 Phase Space Sampling for Calculating the Absorption Spectrum of the Hydrated Electron
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-05-10
err1
errOAAI
errTuri, Laszlo; Baranyi, Bence; Madarasz, Adam
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N-Alkylated Pyridoxal Derivatives as Negative Electrolyte Materials for Aqueous Organic Flow Batteries: Computational Screening
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2023-06-30
err2
errOAAI
errHamza, Andrea; Nemeth, Flora B.; Madarasz, Adam; Nechaev, Anton; Pihko, Petri M.; Peljo, Pekka; Papai, Imre
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Prediction of Redox Power for Photocatalysts: Synergistic Combination of DFT and Machine Learning
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-06-29
err8
errOAAI
errFeher, Peter Pal; Madarasz, Adam; Stirling, Andras
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Carboxylate Catalyzed Isomerization of β,γ-Unsaturated N-Acetylcysteamine Thioesters
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2022-06-20
err4
errOAAI
errRiuttamaki, Saara; Laczko, Gergely; Madarasz, Adam; Foldes, Tamas; Papai, Imre; Bannykh, Anton; Pihko, Petri M.
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Two Faces of the Two-Phase Thermodynamic Model
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-10-14
err3
errOAAI
errMadarasz, Adam; Hamza, Andrea; Ferenc, David; Bako, Imre
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Multiscale Modeling of Electronic Spectra Including Nuclear Quantum Effects
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-09-28
err12
errOAAI
errFeher, Peter P.; Madarasz, Adam; Stirling, Andras
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Air-stable 18-electron adducts of Schrock catalysts with tuned stability constants for spontaneous release of the active species
errCOMMUNICATIONS CHEMISTRY
IF6.2
err2021-05-19
err4
errOAAI
errGulyas, Henrik; Hayano, Shigetaka; Madarasz, Adam; Papai, Imre; Szabo, Mark; Bucsai, Agota; Martin, Eddy; Benet-Buchholz, Jordi
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Nuclear quantum effects: Their relevance in neutron diffraction studies of liquid water
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2021-03-01
err2
errOAAI
errBako, Imre; Madarasz, Adam; Pusztai, Laszlo
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Nuclear Quantum Effects from the Analysis of Smoothed Trajectories: Pilot Study for Water
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2020-04-08
err9
errOAAI
errBerta, Denes; Ferenc, David; Bako, Imre; Madarasz, Adam
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Stereocontrol in Diphenyiprolinol Silyl Ether Catalyzed Michael Additions: Steric Shielding or Curtin-Hammett Scenario?
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2017-11-13
err33
errOAAI
errFoldes, Tamas; Madarasz, Adam; Revesz, Agnes; Dobi, Zoltan; Varga, Szilard; Hamza, Andrea; Nagy, Peter R.; Pihko, Petri M.; Papai, Imre
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Organocatalysts Fold To Generate an Active Site Pocket for the Mannich Reaction
errACS CATALYSIS
IF13.1
err2017-04-06
err24
errOAAI
errNeuvonen, Antti J.; Foldes, Tamas; Madarasz, Adam; Papai, Imre; Pihko, Petri M.
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Thiourea Derivatives as Bronsted Acid Organocatalysts
errACS CATALYSIS
IF13.1
err2016-06-10
err82
errOAAI
errMadarasz, Adam; Dosa, Zsolt; Varga, Szilard; Soos, Tibor; Csampai, Antal; Papai, Imre
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Development of a True Transition State Force Field from Quantum Mechanical Calculations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2016-03-24
err28
PREAI
errMadarasz, Adam; Berta, Denes; Paton, Robert S.
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A Catalyst Designed for the Enantioselective Construction of Methyland Alkyl-Substituted Tertiary Stereocenters
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2015-11-25
err22
PREAI
errClaraz, Aurelie; Sahoo, Gokarneswar; Berta, Denes; Madarasz, Adam; Papai, Imre; Pihko, Petri M.
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Cross-Dehydrogenative Couplings between Indoles and β-Keto Esters: Ligand-Assisted Ligand Tautomerization and Dehydrogenation via a Proton-Assisted Electron Transfer to Pd(II)
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2014-04-16
err50
errOAAI
errLeskinen, Mikko V.; Madarasz, Adam; Yip, Kai-Tai; Vuorinen, Aini; Papai, Imre; Neuvonen, Antti J.; Pihko, Petri M.
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A frustrated-Lewis-pair approach to catalytic reduction of alkynes to cis-alkenes
errNATURE CHEMISTRY
IF20.2
err2013-07-07
err355
errOAAI
errChernichenko, Konstantin; Madarasz, Adam; Papai, Imre; Nieger, Martin; Leskela, Markku; Repo, Timo
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Dihydrooxazine Oxides as Key Intermediates in Organocatalytic Michael Additions of Aldehydes to Nitroalkenes
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2012-11-13
err82
PREAI
errSahoo, Gokarneswar; Rahaman, Hasibur; Madarasz, Adam; Papai, Imre; Melarto, Mikko; Valkonen, Arto; Pihko, Petri M.
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Research Directions

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Co-authors
Cooperation Journals
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Markku Leskelä
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Kari Rissanen
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Peter J. Rossky
H-index: 80 · Papers: 327
M
Martin Nieger
H-index: 64 · Papers: 4.3K
R
Robert S. Paton
H-index: 64 · Papers: 590
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