PHYSICS, CHEMISTRY AND APPLICATION OF NANOSTRUCTURES, 2001 INVITED STRESS AND STRAIN DISTRIBUTIONS IN Ge DOTS ON Si (001) BY MOLECULAR DYNAMICS SIMULATION.

P RAITERI , F VALENTINOTTI , L MIGLIO
Physics, Chemistry and Application of Nanostructures: Review and Short Notes to Nanomeeting-2001: Minsk, Belarus 22-25 May 2001 69 -69

2001
STRESS AND STRAIN DISTRIBUTIONS IN Ge DOTS ON Si (001) BY MOLECULAR DYNAMICS SIMULATION.

P RAITERI , F VALENTINOTTI , L MIGLIO
Physics, Chemistry and Application of Nanostructures: Review and Short Notes to Nanomeeting-2001: Minsk, Belarus 22-25 May 2001 69 -69

2001
Reactive force field simulation of proton diffusion in BaZrO3 using an empirical valence bond approach

Paolo Raiteri , Julian D Gale , Giovanni Bussi
Journal of Physics: Condensed Matter 23 ( 33) 334213 -334213

29
2011
The atomic structure and dynamics at the CaCO3 vaterite-water interface: A classical molecular dynamics study.

Paolo Raiteri , Raffaella Demichelis , Alicia Schuitemaker
Journal of Chemical Physics 154 ( 16) 164504 -164504

2021
Uncovering the Role of Bicarbonate in Calcium Carbonate Formation at Near-Neutral pH.

Paolo Raiteri , Julian D Gale , Ashit Rao , Markus Drechsler
Angewandte Chemie

2021
Synthesis, photophysical and electrochemical investigation of dinuclear tetrazolato-bridged rhenium complexes

Phillip J Wright , Sara Muzzioli , Melissa V Werrett , Paolo Raiteri
Organometallics 31 ( 21) 7566 -7578

28
2012
Ligand-Induced Structural, Photophysical, and Electrochemical Variations in Tricarbonyl Rhenium(I) Tetrazolato Complexes

Phillip J. Wright , Mark G. Affleck , Sara Muzzioli , Brian W. Skelton
Organometallics 32 ( 13) 3728 -3737

24
2013
Influence of Temperature and Anisotropic Pressure on the Phase Transitions inα-Cristobalite

Davide Donadio , Roman Martoňák , Paolo Raiteri , Michele Parrinello
Physical Review Letters 100 ( 16) 165502

35
2008
The Structure of CaSO4 Nanorods: The Precursor of Gypsum

Tomasz M. Stawski , Alexander E. S. Van Driessche , Rogier Besselink , Emily H. Byrne
Journal of Physical Chemistry C 123 ( 37) 23151 -23158

7
2019
Unravelling the Shuttling Mechanism in a Photoswitchable Multicomponent Bistable Rotaxane

Paolo Raiteri , Giovanni Bussi , Clotilde S. Cucinotta , Alberto Credi
Angewandte Chemie 47 ( 19) 3536 -3539

49
2008
Is the Calcite–Water Interface Understood? Direct Comparisons of Molecular Dynamics Simulations with Specular X-ray Reflectivity Data

Paul Fenter , Sebastien Kerisit , Paolo Raiteri , Julian D. Gale
Journal of Physical Chemistry C 117 ( 10) 5028 -5042

96
2013
Water Structure, Dynamics and Ion Adsorption at the Aqueous {010} Brushite Surface

Natalya Garcia , Paolo Raiteri , Elias Vlieg , Julian Gale
Minerals 8 ( 8) 334

4
2018
Structure, Energetics, and Dynamics of Screw Dislocations in Even n-Alkane Crystals.

Isabel A. Olson , Alexander G. Shtukenberg , Gagik Hakobyan , Andrew L. Rohl
Journal of Physical Chemistry Letters 7 ( 16) 3112 -3117

2
2016
Photophysical and photochemical trends in tricarbonyl rhenium(I) N-heterocyclic carbene complexes

Jamila G. Vaughan , Brodie L. Reid , Phillip J. Wright , Sushil Ramchandani
Inorganic Chemistry 53 ( 7) 3629 -3641

35
2014
Simulation of calcium phosphate prenucleation clusters in aqueous solution : association beyond ion pairing

Natalya A. Garcia , Riccardo Innocenti Malini , Colin L. Freeman , Raffaella Demichelis
Crystal Growth & Design 19 ( 11) 6422 -6430

7
2019
Short-Range Structure of Amorphous Calcium Hydrogen Phosphate

Bing-Qiang Lu , Natalya A. Garcia , Daniel M. Chevrier , Peng Zhang
Crystal Growth & Design 19 ( 5) 3030 -3038

7
2019
Can Point Defects in Surfaces in Solution be Atomically Resolved by Atomic Force Microscopy

Bernhard Reischl , Paolo Raiteri , Julian D. Gale , Andrew L. Rohl
Physical Review Letters 117 ( 22) 226101 -226101

17
2016
Difference Hirshfeld fingerprint plots: a tool for studying polymorphs

Damien J. Carter , Paolo Raiteri , Keith R. Barnard , Rhian Gielink
CrystEngComm 19 ( 16) 2207 -2215

10
2017
Anisotropy of Earth's D″ layer and stacking faults in the MgSiO3 post-perovskite phase

Artem R. Oganov , Roman Martoňák , Alessandro Laio , Paolo Raiteri
Nature 438 ( 7071) 1142 -1144

270
2005
Computational Insight into Calcium–Sulfate Ion Pair Formation

Emily H. Byrne , Paolo Raiteri , Julian D. Gale
Journal of Physical Chemistry C 121 ( 46) 25956 -25966

2017