Nardelli, Marco Buongiorno

1. The AFLOW Standard for High-Throughput Materials Science Calculations
   2015/05/31 by Camilo E. Calderon, Camilo E. Calderón, Jose J. Plata +22 · 11 citations
   Materials Science · Physics and Astronomy · #Advanced Chemical Physics Studies #Catalytic Processes in Materials Science #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #cond-mat.mtrl-sci
2. Advanced modeling of materials with PAOFLOW 2.0: New features and\n software design
   2021/07/27 by Frank Cerasoli, Andrew Supka, Cerasoli, Frank T. +17 · 5 citations
   Engineering · Materials Science · Physics and Astronomy · #Advanced Chemical Physics Studies #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Molecular Junctions and Nanostructures
3. Coordination corrected ab initio formation enthalpies
   2018/11/21 by Rico Friedrich, Friedrich, Rico, Demet Usanmaz +13 · 3 citations
   Chemistry · Materials Science · #FOS: Physical sciences #Inorganic Chemistry and Materials #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #X-ray Diffraction in Crystallography
4. Improved predictions of the physical properties of Zn- and Cd-based wide band-gap semiconductors: a validation of the ACBN0 functional
   2015/05/20 by Priya Gopal, Marco Fornari, Gopal, Priya +10 · 1 citation
   Engineering · Materials Science · Physics and Astronomy · #Electronic and Structural Properties of Oxides #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Semiconductor materials and devices #Surface and Thin Film Phenomena #cond-mat.mtrl-sci
5. High-Throughput Prediction of Finite-Temperature Properties using the\n Quasi-Harmonic Approximation
   2016/03/22 by Pinku Nath, Nath, Pinku, José J. Plata +13 · 1 citation
   Materials Science · #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Thermal properties of materials #X-ray Diffraction in Crystallography
6. AFLUX: The LUX materials search API for the AFLOW data repositories
   2016/12/15 by Frisco Rose, Rose, Frisco, Cormac Toher +11 · 1 citation
   Decision Sciences · Materials Science · #Catalytic Processes in Materials Science #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Scientific Computing and Data Management
7. Relaxation time approximations in PAOFLOW 2.0
   2021/11/17 by Anooja Jayaraj, Jayaraj, Anooja, Ilaria Siloi +5 · 1 citation
   Materials Science · Physics and Astronomy · #Advanced Thermoelectric Materials and Devices #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Surface and Thin Film Phenomena
8. Persistent spin textures, altermagnetism and charge-to-spin conversion in metallic chiral crystals TM₃X₆
   2025/08/01 by Tenzin, Karma, Kilic, Berkay, Sattigeri, Raghottam +6 · 3 citations
   #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci)