Nicolas Poilvert

Pennsylvania State University — United States

Materials Science · Physical Sciences

7h-index453citations20works0.02yr avg
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Research Topics

Machine Learning in Materials Science(7), Advanced Chemical Physics Studies(6), Molecular Junctions and Nanostructures(5), Carbon Nanotubes in Composites(3), Thermal properties of materials(3)

Publications20 total

Achieving Minimal Heat Conductivity by Ballistic Confinement in Phononic Metalattices
ACS Nano·2020· 19 citedOpen Access
Minimizing Heat Transport by Ballistic Confinement in Phononic Metalattices
Bulletin of the American Physical Society·2020
A silicon microwire under a three-dimensional anisotropic tensile stress
Applied Physics Letters·2017Open Access
Single-Crystal Silicon Optical Fiber by Direct Laser Crystallization
ACS Photonics·2016· 59 citedOpen Access
Thermoelectric properties of inverse opals
Journal of Applied Physics·2016· 4 cited
Computational XPS from Koopmans compliant Functionals
Bulletin of the American Physical Society·2015
Quantum Energy Regression using Scattering Transforms
arXiv (Cornell University)·2015· 20 citedOpen Access
Koopmans-Compliant Self-Interaction Corrections
Advances in atomic, molecular, and optical physics·2015· 5 cited
Charged excitations in extended nanostructures from Koopmans-compliant functionals
Bulletin of the American Physical Society·2014
Donor and acceptor levels of organic photovoltaic compounds from first principles
Physical Chemistry Chemical Physics·2012· 39 citedOpen Access
Electronic and dielectric properties of organic photovoltaic compounds from first principles
Bulletin of the American Physical Society·2012
Variational Minimization of Orbital-dependent Density Functionals
arXiv (Cornell University)·2011· 4 citedOpen Access
Automated quantum conductance calculations using maximally-localised Wannier functions
Computer Physics Communications·2011· 33 citedOpen Access
Switchable Conductance in Functionalized Carbon Nanotubes <i>via</i> Reversible Sidewall Bond Cleavage
ACS Nano·2011· 12 citedOpen Access
Extending the predictive power and scope of electronic structure theory and quantum transport
DSpace@MIT (Massachusetts Institute of Technology)·2011Open Access
Koopmans’ condition for density-functional theory
Physical Review B·2010· 258 citedOpen Access
Koopmans' condition for density-functional theory
DSpace@MIT (Massachusetts Institute of Technology)·2010Open Access
Non-Koopmans correction to the convexity and inaccuracy of orbital levels in local and semilocal density-functional theories
Bulletin of the American Physical Society·2010
First-Principles Design of Conductance Switching in Functionalized Carbon Nanotubes
Infoscience (Ecole Polytechnique Fédérale de Lausanne)·2010Open Access
Towards switchable carbon nanotube interconnects
APS March Meeting Abstracts·2009

Frequent Co-authors

Ismaïla Dabo(13), Nicola Marzari(10), Andrea Ferretti(6), Matteo Cococcioni(5), Hiu Yan Cheng(4), John V. Badding(4), Venkatraman Gopalan(4), Suzanne E. Mohney(3), Cheol-Hwan Park(3), G. D. Mahan(3), Vincent H. Crespi(3), Yanli Li(2), Xiaoyu Ji(2), Yihuang Xiong(2), Disha Talreja(2), Pratibha Mahale(2), Nabila Nabi Nova(2), Jennifer L. Russell(2), Thomas E. Mallouk(2), Brian M. Foley(2)