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Felix Cosmin Mocanu
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Modeling the Phase-Change Memory Material, Ge2Sb2Te5, with a Machine-Learned Interatomic Potential
FC Mocanu, K Konstantinou, TH Lee, N Bernstein, VL Deringer, G Csányi, ...
The Journal of Physical Chemistry B 122 (38), 8998-9006, 2018
1312018
Similarity Between Amorphous and Crystalline Phases: The Case of TiO2
J Mavračić, FC Mocanu, VL Deringer, G Csányi, SR Elliott
The journal of physical chemistry letters 9 (11), 2985-2990, 2018
1022018
Revealing the intrinsic nature of the mid-gap defects in amorphous Ge2Sb2Te5
K Konstantinou, FC Mocanu, TH Lee, SR Elliott
Nature Communications 10 (1), 3065, 2019
962019
Origin of radiation tolerance in amorphous Ge2Sb2Te5 phase-change random-access memory material
K Konstantinou, TH Lee, FC Mocanu, SR Elliott
Proceedings of the National Academy of Sciences 115 (21), 5353-5358, 2018
372018
Quench-rate and size-dependent behaviour in glassy Ge2Sb2Te5 models simulated with a machine-learned Gaussian approximation potential
FC Mocanu, K Konstantinou, SR Elliott
Journal of Physics D: Applied Physics 53 (24), 244002, 2020
272020
Modeling electrical percolation to optimize the electromechanical properties of CNT/polymer composites in highly stretchable fiber strain sensors
S Jung, HW Choi, FC Mocanu, DW Shin, MF Chowdhury, SD Han, ...
Scientific reports 9 (1), 20376, 2019
202019
Multi-Scale Electrolyte Transport Simulations for Lithium Ion Batteries
F Hanke, N Modrow, RLC Akkermans, I Korotkin, FC Mocanu, VA Neufeld, ...
Journal of The Electrochemical Society 167 (1), 013522, 2020
192020
Simulation of Phase‐Change‐Memory and Thermoelectric Materials using Machine‐Learned Interatomic Potentials: Sb2Te3
K Konstantinou, J Mavračić, FC Mocanu, SR Elliott
physica status solidi (b) 258 (9), 2000416, 2021
172021
Electric-field-induced annihilation of localized gap defect states in amorphous phase-change memory materials
K Konstantinou, FC Mocanu, J Akola, SR Elliott
Acta Materialia 223, 117465, 2022
162022
On the Chemical Bonding of Amorphous Sb2Te3
FC Mocanu, K Konstantinou, J Mavračić, SR Elliott
physica status solidi (RRL)–Rapid Research Letters 15 (3), 2000485, 2021
152021
Ab initio computer simulations of non-equilibrium radiation-induced cascades in amorphous Ge2Sb2Te5
K Konstantinou, FC Mocanu, TH Lee, SR Elliott
Journal of Physics: Condensed Matter 30 (45), 455401, 2018
142018
Microscopic observation of two-level systems in a metallic glass model
FC Mocanu, L Berthier, S Ciarella, D Khomenko, DR Reichman, C Scalliet, ...
The Journal of Chemical Physics 158 (1), 2023
72023
Finding defects in glasses through machine learning
S Ciarella, D Khomenko, L Berthier, FC Mocanu, DR Reichman, C Scalliet, ...
Nature Communications 14 (1), 4229, 2023
42023
Electron localization in recrystallized models of the phase-change memory material
K Konstantinou, FC Mocanu, J Akola
Physical Review B 106 (18), 184103, 2022
42022
Robust In-Zn-O Thin-Film Transistors with a Bilayer Heterostructure Design and a Low-Temperature Fabrication Process Using Vacuum and Solution Deposited Layers
SY Bang, FC Mocanu, TH Lee, J Yang, S Zhan, SM Jung, DW Shin, ...
ACS omega 5 (34), 21593-21601, 2020
42020
Evolution of local structural motifs in colloidal quantum dot semiconductor nanocrystals leading to nanofaceting
B Hou, FC Mocanu, Y Cho, J Lim, J Feng, J Zhang, J Hong, S Pak, ...
Nano Letters 23 (6), 2277-2286, 2023
22023
Elucidation of the Nature of Structural Relaxation in Glassy D-Sorbitol
M Krynski, FC Mocanu, SR Elliott
The Journal of Physical Chemistry B, 2020
22020
Nonequilibrium ab initio molecular-dynamics simulations of lattice thermal conductivity in irradiated glassy Ge2Sb2Te5
FC Mocanu, K Konstantinou, SR Elliott
Applied Physics Letters 116 (3), 2020
22020
The nature of non-phononic excitations in disordered systems
W Schirmacher, M Paoluzzi, FC Mocanu, D Khomenko, G Szamel, ...
arXiv preprint arXiv:2310.02983, 2023
12023
First and Second-Principles Atomistic Modelling of Ge-Sb-Te Phase-Change Memory Materials
FC Mocanu
University of Cambridge, 2019
12019
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