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Baima, Jacopo
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1

Anharmonic thermo-elasticity of tungsten from accelerated B..:

Zhong, Anruo ; Lapointe, Clovis ; Goryaeva, Alexandra M....
Physical Review Materials.  7 (2023)  2 - p. , 2023
Link: https://doi.org/10.1103/..
 
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2

Capabilities and limits of autoencoders for extracting coll..:

Baima, Jacopo ; Goryaeva, Alexandra M. ; Swinburne, Thomas D....
Physical Chemistry Chemical Physics.  24 (2022)  38 - p. 23152-23163 , 2022
Link: https://doi.org/10.1039/..
 
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3

Gate-Tunable Magnetism and Giant Magnetoresistance in Suspe..:

Lee, Yongjin ; Che, Shi ; Velasco Jr., Jairo...
Nano Letters.  22 (2022)  13 - p. 5094-5099 , 2022
Link: https://doi.org/10.1021/..
 
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4

Efficient and transferable machine learning potentials for ..:

Goryaeva, Alexandra M. ; Dérès, Julien ; Lapointe, Clovis...
Physical Review Materials.  5 (2021)  10 - p. , 2021
Link: https://doi.org/10.1103/..
 
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5

Optimization of Anticorrosive Zinc Coatings: Tuning the Adh..:

Baima, Jacopo ; Goniakowski, Jacek ; Noguera, Claudine..
The Journal of Physical Chemistry C.  124 (2020)  17 - p. 9337-9344 , 2020
Link: https://doi.org/10.1021/..
 
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6

The CRYSTAL code, 1976–2020 and beyond, a long story:

Dovesi, Roberto ; Pascale, Fabien ; Civalleri, Bartolomeo...
The Journal of Chemical Physics.  152 (2020)  20 - p. , 2020
Link: https://doi.org/10.1063/..
 
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7

Theoretical study of metal/silica interfaces: Ti, Fe, Cr an..:

Baima, Jacopo ; Le, Ha-Linh Thi ; Goniakowski, Jacek...
Physical Chemistry Chemical Physics.  22 (2020)  37 - p. 21453-21462 , 2020
Link: https://doi.org/10.1039/..
 
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8

Surface thermodynamics of silicate compounds: the case of Z..:

Baima, Jacopo ; Goniakowski, Jacek ; Noguera, Claudine..
Physical Chemistry Chemical Physics.  21 (2019)  24 - p. 13287-13295 , 2019
Link: https://doi.org/10.1039/..
 
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9

Quantum‐mechanical condensed matter simulations with CRYSTA:

Dovesi, Roberto ; Erba, Alessandro ; Orlando, Roberto...
WIREs Computational Molecular Science.  8 (2018)  4 - p. , 2018
Link: https://doi.org/10.1002/..
 
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10

Critical Role of the Exchange Interaction for the Electroni..:

Hellgren, Maria ; Baima, Jacopo ; Bianco, Raffaello...
Physical Review Letters.  119 (2017)  17 - p. , 2017
Link: https://doi.org/10.1103/..
 
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11

Raman spectroscopic features of the neutral vacancy in diam..:

Baima, Jacopo ; Zelferino, Alessandro ; Olivero, Paolo..
Physical Chemistry Chemical Physics.  18 (2016)  3 - p. 1961-1968 , 2016
Link: https://doi.org/10.1039/..
 
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12

The electronic states of the neutral vacancy in diamond: a ..:

Zelferino, Alessandro ; Salustro, Simone ; Baima, Jacopo...
Theoretical Chemistry Accounts.  135 (2016)  3 - p. , 2016
Link: https://doi.org/10.1007/..
 
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13

Thermodynamics and phonon dispersion of pyrope and grossula..:

Baima, Jacopo ; Ferrabone, Matteo ; Orlando, Roberto..
Physics and Chemistry of Minerals.  43 (2015)  2 - p. 137-149 , 2015
Link: https://doi.org/10.1007/..
 
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14

Electron density analysis of large (molecular and periodic)..:

Casassa, Silvia ; Erba, Alessandro ; Baima, Jacopo.
Journal of Computational Chemistry.  , 2015
Link: https://doi.org/10.1002/..
 
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15

Direct Piezoelectric Tensor of 3D Periodic Systems through ..:

Baima, Jacopo ; Erba, Alessandro ; Maschio, Lorenzo...
Zeitschrift für Physikalische Chemie.  230 (2015)  5-7 - p. 719-736 , 2015
Link: https://doi.org/10.1515/..
 
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