Role of Quantum-confinement in Anatase nanosheets
Role of Quantum-confinement in Anatase nanosheets
D. Varsano, G. Giorgi, K Yamashita, M. Palummo
J. Phys. Chem. Lett., 2017, 8. 10.1021/acs.jpclett.7b01717
Theoretical S1 ← S0 absorption energies of the anionic forms of oxyluciferin by Variational Monte Carlo and Many Body Green’s Function Theory
Theoretical S1 ← S0 absorption energies of the anionic forms of oxyluciferin by Variational Monte Carlo and Many Body Green’s Function Theory
E. Coccia, D. Varsano, L. Guidoni
Chem. Theory Comput., 2017, 13, 4357. 10.1021/acs.jctc.7b00505
First Principle Studies of B and P Doped Si Nanocrystals
First Principle Studies of B and P Doped Si Nanocrystals
I. Marri, E. Degoli, S. Ossicini
Physica Status Solidi A, 2017, 215, 3. 10.1002/pssa.201700414
Doped and codoped silicon nanocrystals: The role of surfaces and interfaces
Doped and codoped silicon nanocrystals: The role of surfaces and interfaces
I. Marri, E. Degoli, S. Ossicini
Progress in Surface Science, 2017, 92, 4, pp 375-408 10.1016/j.progsurf.2017.07.003
Thermal and transport properties of pristine single-layer hexagonal boron nitride: A first principle investigation
Thermal and transport properties of pristine single-layer hexagonal boron nitride: A first principle investigation
S. Illera, M. Pruneda, L. Colombo, P. Ordejón
Physical Review Materials, 2017, 1, 044006 10.1103/PhysRevMaterials.1.044006
Growth of Twin-Free and Low-Doped Topological Insulators on BaF2(111)
Growth of Twin-Free and Low-Doped Topological Insulators on BaF2(111)
F. Bonell, M.G. Cuxart, K. Song, R. Robles, P. Ordejón, S. Roche, A. Mugarza, S. O. Valenzuela
Crystal Growth & Design, 2017, 17, 4655 10.1021/acs.cgd.7b00525
Voltage-Induced Coercivity Reduction in Nanoporous Alloy Films: A Boost toward Energy-Efficient Magnetic Actuation
Voltage-Induced Coercivity Reduction in Nanoporous Alloy Films: A Boost toward Energy-Efficient Magnetic Actuation
A. Quintana, J. Zhang, E. Isarain-Chávez, E. Menéndez, R. Cuadrado, R. Robles, M. D. Baró, M. Guerrero, S. Pané, B. J. Nelson, C. M. Müller, P. Ordejón, J. Nogués, E. Pellicer, J. Sort
Advanced Functional Materials, 2017, 27, 1701904 10.1002/adfm.201701904
Performance Analysis and Optimization of the FFTXlib on the Intel Knights Landing Architecture
Performance Analysis and Optimization of the FFTXlib on the Intel Knights Landing Architecture
M. Wagner, V. López, J. Morillo, C. Cavazzoni, F. Affinito, J. Giménez, J. Labarta
46th International Conference on Parallel Processing Workshops (ICPPW), 2017. 10.1109/ICPPW.2017.44
A Performance Study of Quantum ESPRESSO’s PWscf Code on Multi-core and GPU Systems
A Performance Study of Quantum ESPRESSO’s PWscf Code on Multi-core and GPU Systems
J. Romero, E. Phillips, G. Ruetsch, M. Fatica, F. Spiga, P. Giannozzi
In: High Performance Computing Systems. Performance Modeling, Benchmarking, and Simulation. PMBS 2017. Lecture Notes in Computer Science, 2017, 10724. 10.1007/978-3-319-72971-8_4
Carbon nanotubes as excitonic insulators
Carbon nanotubes as excitonic insulators
D. Varsano, S. Sorella, D. Sangalli, M. Barborini, S. Corni, E. Molinari, M. Rontani
Nature Communications, 2017, 8 1461. 10.1038/s41467-017-01660-8