All papers authored by Raffaella Demichelis
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2020
Julie Aufort 
,
Raffaella Demichelis
,
Raffaella Demichelis
Magnesium Impurities Decide the Structure of Calcium Carbonate Hemihydrate
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Roberto Dovesi ,
Fabien Pascale ,
Bartolomeo Civalleri ,
Klaus Doll ,
Nicholas M. Harrison ,
Ian Bush,
Philippe D’Arco ,
Yves Noël,
Michel Rérat ,
Philippe Carbonnière,
Mauro Causà,
Simone Salustro ,
Valentina Lacivita ,
Bernard Kirtman,
Anna Maria Ferrari
and 5 other authors
,
Fabien Pascale ,
Bartolomeo Civalleri ,
Klaus Doll ,
Nicholas M. Harrison ,
Ian Bush,
Philippe D’Arco ,
Yves Noël,
Michel Rérat ,
Philippe Carbonnière,
Mauro Causà,
Simone Salustro ,
Valentina Lacivita ,
Bernard Kirtman,
Anna Maria Ferrari
and 5 other authors
The CRYSTAL code, 1976–2020 and beyond, a long story
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2019
Natalya A. Garcia,
Riccardo Innocenti Malini ,
Colin L. Freeman,
Raffaella Demichelis ,
Paolo Raiteri ,
Nico A. J. M. Sommerdijk ,
John H. Harding,
Julian D. Gale
Download from pubs.acs.org
,
Colin L. Freeman,
Raffaella Demichelis ,
Paolo Raiteri ,
Nico A. J. M. Sommerdijk ,
John H. Harding,
Julian D. Gale
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Wenge Jiang,
Dimitra Athanasiadou,
Shaodong Zhang ,
Raffaella Demichelis ,
Katarzyna B. Koziara,
Paolo Raiteri ,
Valentin Nelea,
Wenbo Mi ,
Jun-An Ma,
Julian D. Gale ,
Marc D. McKee
Download from doi.org
,
Raffaella Demichelis ,
Katarzyna B. Koziara,
Paolo Raiteri ,
Valentin Nelea,
Wenbo Mi ,
Jun-An Ma,
Julian D. Gale ,
Marc D. McKee
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2018
Raffaella Demichelis ,
Alicia Schuitemaker,
Natalya A. Garcia,
Katarzyna B. Koziara,
Marco De La Pierre,
Paolo Raiteri,
Julian D. Gale
,
Alicia Schuitemaker,
Natalya A. Garcia,
Katarzyna B. Koziara,
Marco De La Pierre,
Paolo Raiteri,
Julian D. Gale
Simulation of Crystallization of Biominerals
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2016
Raffaella Demichelis ,
Paolo Raiteri,
Julian D. Gale
,
Paolo Raiteri,
Julian D. Gale
Ab Initio Modelling of the Structure and Properties of Crystalline Calcium Carbonate
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Marco De La Pierre,
Raffaella Demichelis ,
Roberto Dovesi
,
Roberto Dovesi
Vibrational Spectroscopy of Minerals ThroughAb InitioMethods
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Raffaella Demichelis ,
Marco De La Pierre,
Mainak Mookherjee,
Claudio M. Zicovich-Wilson,
Roberto Orlando
,
Marco De La Pierre,
Mainak Mookherjee,
Claudio M. Zicovich-Wilson,
Roberto Orlando
Serpentine polymorphism: a quantitative insight from first-principles calculations
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Yi Cheng,
Amir Memar,
Martin Saunders,
Jian Pan ,
Chang Liu,
Julian D. Gale,
Raffaella Demichelis ,
Pei Kang Shen,
San Ping Jiang
,
Chang Liu,
Julian D. Gale,
Raffaella Demichelis ,
Pei Kang Shen,
San Ping Jiang
Dye functionalized carbon nanotubes for photoelectrochemical water splitting - role of inner tubes
Download from www.researchgate.net
Alessandro Erba,
Jefferson Maul,
Raffaella Demichelis ,
Roberto Dovesi
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,
Roberto Dovesi
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