Publications

2020

M. Mrudul, Nicolas Tancogne-Dejean, Angel Rubio, Gopal Dixit; High-harmonic generation from spin-polarised defects in solids, NPJ COMPUTATIONAL MATERIALS 6, 10. 10.1038/s41524-020-0275-z
Andrea Droghetti, Ivan Rungger; Enhanced thermopower in covalent graphite-molecule contacts, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 22, 1466-1474. 10.1039/c9cp05474j
Lianhua He, Fang Liu, Ju Li, Gian-Marco Rignanese, Aihui Zhou; First-principles investigation of monatomic gold wires under tension, COMPUTATIONAL MATERIALS SCIENCE 171, UNSP 109226. 10.1016/j.commatsci.2019.109226

2019

Nicolas Gauriot, Valerie Veniard, Eleonora Luppi; Long-range corrected exchange-correlation kernels to describe excitons in second-harmonic generation, JOURNAL OF CHEMICAL PHYSICS 151, 234111. 10.1063/1.5126501
Andi Rabia, Francesco Tumino, Alberto Milani, Valeria Russo; Scanning tunneling microscopy and Raman spectroscopy of polymeric sp-sp(2) carbon atomic wires synthesized on the Au(111) surface, NANOSCALE 11, 18191-18200. 10.1039/c9nr06552k
Jacek Bagniuk, Dominika Pawcenis, Adriano Mosca Conte, Olivia Pulci, Monika Aksamit-Koperska, Mauro Missori, Joanna Lojewska; How to estimate cellulose condition in insulation transformers papers? Combined chromatographic and spectroscopic study, POLYMER DEGRADATION AND STABILITY 168, UNSP 108951. 10.1016/j.polymdegradstab.2019.108951
DJ Mowbray, Vito Despoja; Tailoring a Molecule s Optical Absorbance Using Surface Plasmonics, JOURNAL OF PHYSICAL CHEMISTRY C 123, 26498-26508. 10.1021/acs.jpcc.9b05770
Nahual Sobrino, Roberto D'Agosta, Stefan Kurth; Steady-state density functional theory for thermoelectric effects, PHYSICAL REVIEW B 100, 195142. 10.1103/PhysRevB.100.195142
Stefano Di Sabatino, JA Berger, Pina Romaniello; Many-Body Effective Energy Theory: Photoemission at Strong Correlation, JOURNAL OF CHEMICAL THEORY AND COMPUTATION 15, 5080-5086. 10.1021/acs.jctc.9b00427
Robert Biele, Roberto D'Agosta; Beyond the State of the Art: Novel Approaches for Thermal and Electrical Transport in Nanoscale Devices, ENTROPY 2110.3390/e21080752

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