Evolutionary Algorithm-Based Crystal Structure Prediction of Cu(x)Zn(y)O(z) Ternary Oxides

por Kuklin, Mikhail S., Karttunen, Antti J.
Publicado 2023

Crystal Structure Prediction of Magnetic Transition-Metal Oxides by Using Evolutionary Algorithm and Hybrid DFT Methods

por Kuklin, Mikhail S., Karttunen, Antti J.
Publicado 2018

Structural Properties and Magnetic Ground States of 100 Binary d-Metal Oxides Studied by Hybrid Density Functional Methods

por Kuklin, Mikhail S., Eklund, Kim, Linnera, Jarno, Ropponen, Artturi, Tolvanen, Nikolas, Karttunen, Antti J.
Publicado 2022