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Paolo Raiteri

Curtin University

45H-index
254Paper Count
1.2WCitation Count
Published Papers 75
Publication Date
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Reconstruction of the {1014} Calcite Surface: When, How, and Why
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2025-12-01
err0
PREAI
errDemichelis, Raffaella; Raiteri, Paolo; Gale, Julian D.
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Methylated regioisomers of Re(I) and Ir(III) tetrazole complexes: photophysical properties and optical imaging of brain tissue
errDalton Trans.
IF3.3
err2025-11-18
err0
PREAI
errElena Dallerba; Lee Cameron; Blake I Armstrong; Gaewyn Ellison; Eva Turner; Evelyn Innes; Georgia L Strickling; Joel Ethan Pangiarella; Peter O'Conghaile; Michael Nesbit; Stephen A. Moggach; Paolo Raiteri; Stefano Stagni; Emma Pearson; Mark Hackett; Massimiliano Massi
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Atomistic insight into the interaction of aspartic acid species with calcium carbonate: model development
errFaraday Discuss.
IF3.1
err2025-09-30
err0
PREAI
errRaffaella Demichelis; Blake I. Armstrong; Paolo Raiteri; Julian D. Gale
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errSave
PLUMED Tutorials: A collaborative, community-driven learning ecosystem
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-03-07
err1
PREAI
errTribello, Gareth A.; Bonomi, Massimiliano; Bussi, Giovanni; Camilloni, Carlo; Armstrong, Blake I.; Arsiccio, Andrea; Aureli, Simone; Ballabio, Federico; Bernetti, Mattia; Bonati, Luigi; Brookes, Samuel G. H.; Brotzakis, Z. Faidon; Capelli, Riccardo; Ceriotti, Michele; Chan, Kam-Tung; Cossio, Pilar; Dasetty, Siva; Donadio, Davide; Ensing, Bernd; Ferguson, Andrew L.; Fraux, Guillaume; Gale, Julian D.; Gervasio, Francesco Luigi; Giorgino, Toni; Herringer, Nicholas S. M.; Hocky, Glen M.; Hoff, Samuel E.; Invernizzi, Michele; Languin-Cattoen, Olivier; Leone, Vanessa; Limongelli, Vittorio; Lopez-Acevedo, Olga; Marinelli, Fabrizio; Febrer Martinez, Pedro; Masetti, Matteo; Mehdi, Shams; Michaelides, Angelos; Murtada, Mhd Hussein; Parrinello, Michele; Piaggi, Pablo M.; Pietropaolo, Adriana; Pietrucci, Fabio; Pipolo, Silvio; Pritchard, Claire; Raiteri, Paolo; Raniolo, Stefano; Rapetti, Daniele; Rizzi, Valerio; Rydzewski, Jakub; Salvalaglio, Matteo; Schran, Christoph; Seal, Aniruddha; Shayesteh Zadeh, Armin; Silva, Tomas F. D.; Spiwok, Vojtech; Stirnemann, Guillaume; Sucerquia, Daniel; Tiwary, Pratyush; Valsson, Omar; Vendruscolo, Michele; Voth, Gregory A.; White, Andrew D.; Wu, Jiangbo
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Thermodynamics of Magnesium Binding at Calcite Kink Sites and Implications for Growth inhibition
errCRYSTAL GROWTH & DESIGN
IF3.4
err2024-10-10
err0
PREAI
errAufort, Julie; Armstrong, Blake I.; Raiteri, Paolo; Gale, Julian D.
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errSave
Elucidating the Mechanism of Efficient Eu(III) and Yb(III) Sensitisation from a Re(I) Tetrazolato Triangular Assembly
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2024-08-12
err0
errOAAI
errWright, Phillip J.; Pfrunder, Michael C.; Etchells, Isaac M.; Haghighatbin, Mohammad A.; Raiteri, Paolo; Ogden, Mark I.; Stagni, Stefano; Hogan, Conor F.; Cameron, Lee J.; Moore, Evan G.; Massi, Massimiliano
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Redefined ion association constants have consequences for calcium phosphate nucleation and biomineralization
errNATURE COMMUNICATIONS
IF15.7
err2024-04-18
err1
errOAAI
errMcDonogh, David P.; Gale, Julian D.; Raiteri, Paolo; Gebauer, Denis
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errSave
Atomistic simulations of calcium aluminosilicate interfaced with liquid water
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-09-11
err2
errOAAI
errVukovic, F.; Garcia, N. A.; Perera, S.; Turchi, M.; Andersson, M. P.; Solvang, M.; Raiteri, P.; Walsh, T. R.
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errSave
Determining the Complete Stability of Calcite Kink Sites: Real vs Ideal
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2023-07-05
err4
PREAI
errArmstrong, Blake I.; Silvestri, Alessandro; De La Pierre, Marco; Raiteri, Paolo; Gale, Julian D.
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Solubility-consistent force field simulations for aqueous metal carbonate systems using graphical processing units
errPHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
IF3.7
err2023-05-22
err6
errOAAI
errArmstrong, Blake; Silvestri, Alessandro; Demichelis, Raffaella; Raiteri, Paolo; Gale, Julian D.
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errSave
Revisiting the Conformational Isomerism of Dihaloethanes: A Hybrid Computational and Experimental Laboratory for the Undergraduate Curriculum
errACS PHYSICAL CHEMISTRY AU
IF4.3
err2023-01-12
err0
errOAAI
errArmstrong, Blake I.; Willans, Meg; Pearson, Emma L.; Becker, Thomas; Hackett, Mark J.; Raiteri, Paolo
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errSave
Obtaining Consistent Free Energies for Ion Binding at Surfaces from Solution: Pathways versus Alchemy for Determining Kink Site Stability
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-09-08
err13
PREAI
errSilvestri, Alessandro; Raiteri, Paolo; Gale, Julian D.
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Determining the Adsorption Free Energies of Small Organic Molecules and Intrinsic Ions at the Terrace and Steps of Calcite
errCRYSTAL GROWTH & DESIGN
IF3.4
err2022-01-18
err10
errOAAI
errAufort, Julie; Schuitemaker, Alicia; Green, Rebecca; Demichelis, Raffaella; Raiteri, Paolo; Gale, Julian D.
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errSave
A Universal Force Field for Materials, Periodic GFN-FF: Implementation and Examination
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-11-04
err22
errOAAI
errGale, Julian D.; LeBlanc, Luc M.; Spackman, Peter R.; Silvestri, Alessandro; Raiteri, Paolo
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Does the Structural Water within Gypsum Remain Crystalline at the Aqueous Interface?
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2021-09-27
err6
errOAAI
errSongen, Hagen; Silvestri, Alessandro; Roshni, Tasnim; Klassen, Stefanie; Bechstein, Ralf; Raiteri, Paolo; Gale, Julian D.; Kuhnle, Angelika
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Structure and Surface Complexation at the Calcite(104)-Water Interface
errENVIRONMENTAL SCIENCE & TECHNOLOGY
IF11.3
err2021-09-03
err18
errOAAI
errHeberling, Frank; Klacic, Tin; Raiteri, Paolo; Gale, Julian D.; Eng, Peter J.; Stubbs, Joanne E.; Gil-Diaz, Teba; Begovic, Tajana; Luetzenkirchen, Johannes
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Uncovering the Role of Bicarbonate in Calcium Carbonate Formation at Near-Neutral pH
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2021-06-18
err30
errOAAI
errHuang, Yu-Chieh; Rao, Ashit; Huang, Shing-Jong; Chang, Chun-Yu; Drechsler, Markus; Knaus, Jennifer; Chan, Jerry Chun Chung; Raiteri, Paolo; Gale, Julian D.; Gebauer, Denis
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The atomic structure and dynamics at the CaCO3 vaterite-water interface: A classical molecular dynamics study
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-04-23
err7
errOAAI
errSchuitemaker, Alicia; Raiteri, Paolo; Demichelis, Raffaella
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Molecular dynamics simulations of liquid-liquid interfaces in an electric field: The water-1,2-dichloroethane interface
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-10-28
err7
errOAAI
errRaiteri, Paolo; Kraus, Peter; Gale, Julian D.
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errSave
Calcite (104) Surface-Electrolyte Structure: A 3D Comparison of Surface X-ray Diffraction and Simulations
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-07-28
err31
errOAAI
errBrugman, Sander J. T.; Raiteri, Paolo; Accordini, Paolo; Megens, Frank; Gale, Julian D.; Vlieg, Elias
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Research Directions

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Co-authors
Cooperation Journals
J
J. Fraser Stoddart
H-index: 175 · Papers: 1.9K
M
Michele Parrinello
H-index: 155 · Papers: 924
M
Michele Vendruscolo
H-index: 118 · Papers: 1.1K
G
Gregory A. Voth
H-index: 114 · Papers: 985
P
Philip A. Gale
H-index: 96 · Papers: 944
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