List of works - Marco Fornari

An updated version of BoltzWann: A code for the evaluation of thermoelectric and electronic transport properties with a maximally-localized Wannier functions basis

BoltzWann: A code for the evaluation of thermoelectric and electronic transport properties with a maximally-localized Wannier functions basis

Density of States for Warped Energy Bands. ⬇️

scientific article published on 24 February 2016

Effects of filling inCoSb3: Local structure, band gap, and phonons from first principles

scholarly article in Physical Review B, vol. 81 no. 4, January 2010

Electronic transport properties of pnictogen-substituted skutterudites with alkaline-earth fillers

Electronic, vibrational, and transport properties of pnictogen-substituted ternary skutterudites

scholarly article in Physical Review B, vol. 85 no. 24, June 2012

First principles NMR study of fluorapatite under pressure

scientific article published on 23 June 2012

Frequency of Filler Vibrations in CoSb3Skutterudites: A Mechanical Interpretation

High-Performance Thermoelectric Bulk Colusite by Process Controlled Structural Disordering

scientific article published on 14 January 2018

High-Throughput Computational Search for Half-Metallic Oxides

scientific article published on 25 April 2020

High-throughput screening of perovskite alloys for piezoelectric performance and thermodynamic stability

scholarly article in Physical Review B, vol. 89 no. 13, April 2014

Hyperbolic Metamaterials with Extreme Mechanical Hardness

scientific article published in 2021

Lead‐Free Polycrystalline Ferroelectric Nanowires with Enhanced Curie Temperature

Quasiharmonic Vibrational Properties of TiNiSn from Ab Initio Phonons

article

Screening for high-performance piezoelectrics using high-throughput density functional theory

scholarly article in Physical Review B, vol. 84 no. 1, July 2011

Structure and dynamics of perovskite hydridesAMgH3(A=Na, K, Rb) in relation to the corresponding fluorides: A first-principles study

article

The 2019 materials by design roadmap

scientific article published on 01 January 2019

The AFLOW standard for high-throughput materials science calculations

scholarly article by Camilo E. Calderon et al published October 2015 in Computational Materials Science

The role of copper in the thermal conductivity of thermoelectric oxychalcogenides: do lone pairs matter?

scientific article published on 12 November 2015

Thermoelectric properties of pnictogen-substituted skutterudites with alkaline-earth fillers using first-principles calculations

Vacancies in graphene: an application of adiabatic quantum optimization

scientific article published on 24 November 2020

Vibrational spectral fingerprinting for chemical recognition of biominerals

scientific article published on 28 February 2020

List of works by Marco Fornari