AD Scientific Index
 Open Nav
Login Login Pricing & Plans Pricing & Plans
Sergey Guda

Sergey Guda

Southern Federal University - Rostov / Russia
Others
AD Scientific Index ID: 4610241
Южный федеральный университет
person_outline Sergey Guda's MOST POPULAR ARTICLES
1-) Optimized finite difference method for the full-potential XANES simulations: Application to molecular adsorption geometries in MOFs and metal–ligand intersystem crossing transients Journal of chemical theory and computation 11 (9), 4512-4521, 2015
2-) Understanding X-ray absorption spectra by means of descriptors and machine learning algorithms npj Computational Materials 7 (1), 203, 2021
3-) PyFitit: The software for quantitative analysis of XANES spectra using machine-learning algorithms Computer Physics Communications 250, 107064, 2020
4-) Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches Catalysis Today 336, 3-21, 2019
5-) Threshold optimization for F measure of macro-averaged precision and recall Pattern Recognition 102, 107250, 2020