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A

Andrea Zen

università di napoli "federico ii"

23H-index
68Paper Count
1.6KCitation Count
Published Papers 40
Publication Date
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Author Correction: The first-principles phase diagram of monolayer nanoconfined water
errNature
IF48.5
err2025-12-02
err0
PREAI
errVenkat Kapil; Christoph Schran; Andrea Zen; Ji Chen; Chris J. Pickard; Angelos Michaelides
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An accurate and efficient framework for modelling the surface chemistry of ionic materials
errNature Chemistry
IF20.2
err2025-08-13
err0
errOAAI
errBenjamin X. Shi; Andrew S. Rosen; Tobias Schäfer; Andreas Grüneis; Venkat Kapil; Andrea Zen; Angelos Michaelides
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Basis Set Incompleteness Errors in Fixed-Node Diffusion Monte Carlo Calculations on Noncovalent Interactions
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-04-30
err0
errOAAI
errNakano, Kousuke; Shi, Benjamin X.; Alfe, Dario; Zen, Andrea
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Cooperative CO2 capture via oxalate formation on metal-decorated graphene
errPHYSICAL REVIEW MATERIALS
IF3.4
err2025-01-17
err0
errOAAI
errPopoola, Inioluwa C.; Shi, Benjamin X.; Michaelides, Angelos; Berger, Fabian; Zen, Andrea; Alfe, Dario; Al-Hamdani, Yasmine S.
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A brief introduction to the diffusion Monte Carlo method and the fixed-node approximation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-12-30
err0
errOAAI
errAnnarelli, Alfonso; Alfe, Dario; Zen, Andrea
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On the increase of the melting temperature of water confined in one-dimensional nano-cavities
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-12-10
err0
errOAAI
errDella Pia, Flaviano; Zen, Andrea; Kapil, Venkat; Thiemann, Fabian L.; Alfe, Dario; Michaelides, Angelos
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Local probing of the nanoscale hydration landscape of kaolinite basal facets in the presence of ions
errMATERIALS TODAY PHYSICS
IF9.7
err2024-08-01
err1
errOAAI
errCafolla, Clodomiro; Bui, Tai; Le, Tran Thi Bao; Zen, Andrea; Tay, Weparn J.; Striolo, Alberto; Michaelides, Angelos; Greenwell, Hugh Christopher; Voitchovsky, Kislon
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Beyond Single-Reference Fixed-Node Approximation in Ab Initio Diffusion Monte Carlo Using Antisymmetrized Geminal Power Applied to Systems with Hundreds of Electrons
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-05-24
err2
errOAAI
errNakano, Kousuke; Sorella, Sandro; Alfe, Dario; Zen, Andrea
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Unraveling H2 chemisorption and physisorption on metal decorated graphene using quantum Monte Carlo
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-11-29
err6
errOAAI
errAl-Hamdani, Yasmine S.; Zen, Andrea; Alfe, Dario
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Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2023-11-10
err18
errOAAI
errShi, Benjamin X.; Zen, Andrea; Kapil, Venkat; Nagy, Peter R.; Gruneis, Andreas; Michaelides, Angelos
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Mesoscale Simulations Reveal How Salt Influences Clay Particles Agglomeration in Aqueous Dispersions
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-11-02
err7
errOAAI
errLe, Tran Thi Bao; Finney, Aaron R.; Zen, Andrea; Bui, Tai; Tay, Weparn J.; Chellappah, Kuhan; Salvalaglio, Matteo; Michaelides, Angelos; Striolo, Alberto
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Mechanisms of adsorbing hydrogen gas on metal decorated graphene
errPHYSICAL REVIEW MATERIALS
IF3.4
err2023-03-13
err17
errOAAI
errAl-Hamdani, Yasmine S.; Zen, Andrea; Michaelides, Angelos; Alfe, Dario
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DMC-ICE13: Ambient and high pressure polymorphs of ice from diffusion Monte Carlo and density functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-10-03
err15
errOAAI
errDella Pia, Flaviano; Zen, Andrea; Alfe, Dario; Michaelides, Angelos
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errSave
QUADRatlas: the RNA G-quadruplex and RG4-binding proteins database
errNUCLEIC ACIDS RESEARCH
IF13.1
err2022-09-16
err11
errOAAI
errBourdon, Sebastien; Herviou, Pauline; Dumas, Leila; Destefanis, Eliana; Zen, Andrea; Cammas, Anne; Millevoi, Stefania; Dassi, Erik
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errSave
The first-principles phase diagram of monolayer nanoconfined water
errNATURE
IF48.5
err2022-09-14
err114
PREAI
errKapil, Venkat; Schran, Christoph; Zen, Andrea; Chen, Ji; Pickard, Chris J.; Michaelides, Angelos
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errSave
Beyond GGA total energies for solids and surfaces
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-08-05
err2
errOAAI
errZen, Andrea; Grueneis, Andreas; Alfe, Dario; Rossi, Mariana
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errSave
Long-Range Ionic and Short-Range Hydration Effects Govern Strongly Anisotropic Clay Nanoparticle Interactions
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2022-05-03
err10
errOAAI
errZen, Andrea; Bui, Tai; Tran Thi Bao Le; Tay, Weparn J.; Chellappah, Kuhan; Collins, Ian R.; Rickman, Richard D.; Striolo, Alberto; Michaelides, Angelos
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General embedded cluster protocol for accurate modeling of oxygen vacancies in metal-oxides
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-03-28
err16
errOAAI
errShi, Benjamin X.; Kapil, Venkat; Zen, Andrea; Chen, Ji; Alavi, Ali; Michaelides, Angelos
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errSave
Defect-Dependent Corrugation in Graphene
errNANO LETTERS
IF9.1
err2021-09-14
err32
errOAAI
errThiemann, Fabian L.; Rowe, Patrick; Zen, Andrea; Muller, Erich A.; Michaelides, Angelos
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Interactions between large molecules pose a puzzle for reference quantum mechanical methods
errNATURE COMMUNICATIONS
IF15.7
err2021-06-24
err64
errOAAI
errAl-Hamdani, Yasmine S.; Nagy, Peter R.; Zen, Andrea; Barton, Dennis; Kallay, Mihaly; Brandenburg, Jan Gerit; Tkatchenko, Alexandre
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Research Directions

No research directions
Co-authors
Cooperation Journals
G
Georg Kresse
H-index: 128 · Papers: 503
C
Chris J. Pickard
H-index: 92 · Papers: 512
A
Angelos Michaelides
H-index: 84 · Papers: 399
A
Alexandre Tkatchenko
H-index: 82 · Papers: 512
M
Massimo Olivucci
H-index: 75 · Papers: 419
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