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Loredana Edith Daga

Showing results (1-10 of 5) with videos related to

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Journal of Chemical Theory and Computation|September 30, 2021
Electronic Excitations in Crystalline Solids through the Maximum Overlap MethodLoredana Edith Daga, Lorenzo Maschio
Journal of Chemical Theory and Computation|March 28, 2020
Gaussian Basis Sets for Crystalline Solids: All-Purpose Basis Set Libraries vs System-Specific OptimizationsLoredana Edith Daga, Bartolomeo Civalleri, Lorenzo Maschio
Physical Chemistry Chemical Physics : PCCP|September 20, 2022
From symmetry breaking in the bulk to phase transitions at the surface: a quantum-mechanical exploration of Li<sub>6</sub>PS<sub>5</sub>Cl argyrodite superionic conductorMaddalena D'Amore, Loredana Edith Daga, Riccardo Rocca, et al.
Nanotechnology|April 28, 2023
Experimental and computational study of the role of defects and secondary phases on the thermoelectric properties of TiNi<sub>1+</sub>Sn (0 ≤<i>x</i>≤ 0.12) half Heusler compoundsEleonora Ascrizzi, Silvia Casassa, Loredana Edith Daga, et al.
Journal of Chemical Theory and Computation|December 11, 2022
CRYSTAL23: A Program for Computational Solid State Physics and ChemistryAlessandro Erba, Jacques K Desmarais, Silvia Casassa, et al.
Pageof 1

Showing results (1-10 of 5) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|September 30, 2021
Electronic Excitations in Crystalline Solids through the Maximum Overlap MethodLoredana Edith Daga, Lorenzo Maschio
Journal of Chemical Theory and Computation|March 28, 2020
Gaussian Basis Sets for Crystalline Solids: All-Purpose Basis Set Libraries vs System-Specific OptimizationsLoredana Edith Daga, Bartolomeo Civalleri, Lorenzo Maschio
Physical Chemistry Chemical Physics : PCCP|September 20, 2022
From symmetry breaking in the bulk to phase transitions at the surface: a quantum-mechanical exploration of Li<sub>6</sub>PS<sub>5</sub>Cl argyrodite superionic conductorMaddalena D'Amore, Loredana Edith Daga, Riccardo Rocca, et al.
Nanotechnology|April 28, 2023
Experimental and computational study of the role of defects and secondary phases on the thermoelectric properties of TiNi<sub>1+</sub>Sn (0 ≤<i>x</i>≤ 0.12) half Heusler compoundsEleonora Ascrizzi, Silvia Casassa, Loredana Edith Daga, et al.
Journal of Chemical Theory and Computation|December 11, 2022
CRYSTAL23: A Program for Computational Solid State Physics and ChemistryAlessandro Erba, Jacques K Desmarais, Silvia Casassa, et al.
Pageof 1