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de Gironcoli, Stefano
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1

Tailored plasmon polariton landscape in graphene/boron nitr..:

Golenić, Neven ; de Gironcoli, Stefano ; Despoja, Vito
npj 2D Materials and Applications.  8 (2024)  1 - p. , 2024
Link: https://doi.org/10.1038/..
 
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2

Growth and Redox Properties of Boron on Al(111): Competing ..:

Biasin, Pietro ; Safari, Mandana ; Ghidorsi, Elena...
ACS Nano.  , 2024
Link: https://doi.org/10.1021/..
 
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3

Optically driven plasmons in graphene/hBN van der Waals het..:

Golenić, Neven ; de Gironcoli, Stefano ; Despoja, Vito
Nanophotonics.  13 (2024)  15 - p. 2765-2780 , 2024
Link: https://doi.org/10.1515/..
 
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4

Divide-and-conquer potentials enable scalable and accurate ..:

Zeni, Claudio ; Anelli, Andrea ; Glielmo, Aldo..
Digital Discovery.  3 (2024)  1 - p. 113-121 , 2024
Link: https://doi.org/10.1039/..
 
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5

Incorporating long-range electrostatics in neural network p..:

Shaidu, Yusuf ; Pellegrini, Franco ; Küçükbenli, Emine..
npj Computational Materials.  10 (2024)  1 - p. , 2024
Link: https://doi.org/10.1038/..
 
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6

Mathematical Analysis and Numerical Approximations of Densi..:

Dai, Xiaoying ; de Gironcoli, Stefano ; Yang, Bin.
Multiscale Modeling & Simulation.  21 (2023)  3 - p. 777-803 , 2023
Link: https://doi.org/10.1137/..
 
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7

From borophene polymorphs towards a single honeycomb boroph..:

Biasin, Pietro ; Safari, Mandana ; Ghidorsi, Elena...
Nanoscale.  15 (2023)  45 - p. 18407-18414 , 2023
Link: https://doi.org/10.1039/..
 
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8

Activation–Relaxation Technique: An efficient way to find m..:

Jay, Antoine ; Gunde, Miha ; Salles, Nicolas...
Computational Materials Science.  209 (2022)  - p. 111363 , 2022
Link: https://doi.org/10.1016/..
 
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9

Data-driven simulation and characterisation of gold nanopar..:

Zeni, Claudio ; Rossi, Kevin ; Pavloudis, Theodore...
Nature Communications.  12 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
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10

A systematic approach to generating accurate neural network..:

Shaidu, Yusuf ; Küçükbenli, Emine ; Lot, Ruggero...
npj Computational Materials.  7 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
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11

Compact atomic descriptors enable accurate predictions via ..:

Zeni, Claudio ; Rossi, Kevin ; Glielmo, Aldo.
The Journal of Chemical Physics.  154 (2021)  22 - p. , 2021
Link: https://doi.org/10.1063/..
 
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12

The CECAM electronic structure library and the modular soft..:

Oliveira, Micael J. T. ; Papior, Nick ; Pouillon, Yann...
The Journal of Chemical Physics.  153 (2020)  2 - p. , 2020
Link: https://doi.org/10.1063/..
 
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13

Finding Reaction Pathways and Transition States: r-ARTn and..:

Jay, Antoine ; Huet, Christophe ; Salles, Nicolas...
Journal of Chemical Theory and Computation.  16 (2020)  10 - p. 6726-6734 , 2020
Link: https://doi.org/10.1021/..
 
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14

Quantum ESPRESSO toward the exascale:

Giannozzi, Paolo ; Baseggio, Oscar ; Bonfà, Pietro...
The Journal of Chemical Physics.  152 (2020)  15 - p. , 2020
Link: https://doi.org/10.1063/..
 
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15

Lithium Adsorption on Graphene at Finite Temperature:

Shaidu, Yusuf ; Küçükbenli, Emine ; de Gironcoli, Stefano
The Journal of Physical Chemistry C.  122 (2018)  36 - p. 20800-20808 , 2018
Link: https://doi.org/10.1021/..
 
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