@article{OmarovaYerezhepAldiyarovetal.2022, author = {Omarova, Zhansaya and Yerezhep, Darkhan and Aldiyarov, Abdurakhman and Tokmoldin, Nurlan}, title = {In Silico Investigation of the Impact of Hole-Transport Layers on the Performance of CH3NH3SnI3 Perovskite Photovoltaic Cells}, series = {Crystals}, volume = {12}, journal = {Crystals}, number = {5}, publisher = {MDPI}, address = {Basel}, issn = {2073-4352}, doi = {10.3390/cryst12050699}, pages = {17}, year = {2022}, abstract = {Perovskite solar cells represent one of the recent success stories in photovoltaics. The device efficiency has been steadily increasing over the past years, but further work is needed to enhance the performance, for example, through the reduction of defects to prevent carrier recombination. SCAPS-1D simulations were performed to assess efficiency limits and identify approaches to decrease the impact of defects, through the selection of an optimal hole-transport material and a hole-collecting electrode. Particular attention was given to evaluation of the influence of bulk defects within light-absorbing CH3NH3SnI3 layers. In addition, the study demonstrates the influence of interface defects at the TiO2/CH3NH3SnI3 (IL1) and CH3NH3SnI3/HTL (IL2) interfaces across the similar range of defect densities. Finally, the optimal device architecture TiO2/CH3NH3SnI3/Cu2O is proposed for the given absorber layer using the readily available Cu2O hole-transporting material with PCE = 27.95\%, FF = 84.05\%, V-OC = 1.02 V and J(SC) = 32.60 mA/cm(2), providing optimal performance and enhanced resistance to defects.}, language = {en} } @article{AldiyarovSokolovAkylbayevaetal.2020, author = {Aldiyarov, Abdurakhman and Sokolov, Dmitriy and Akylbayeva, Aigerim and Nurmukan, Assel and Tokmoldin, Nurlan}, title = {On thermal stability of cryovacuum deposited CH4+H2O films}, series = {Low temperature physics}, volume = {46}, journal = {Low temperature physics}, number = {11}, publisher = {American Institute of Physics}, address = {Melville}, issn = {1063-777X}, doi = {10.1063/10.0002156}, pages = {1121 -- 1124}, year = {2020}, abstract = {Whereas stable homogenous states of aqueous hydrocarbon solutions are typically observed at high temperatures and pressures far beyond the critical values corresponding to individual components, the stability of such system may be preserved upon transition into the region of metastable states at low temperatures and low pressures. This work is dedicated to the study of the thermal stability of a water-methane mixture formed by cryogenic vapor phase deposition. The obtained thin films were studied using vibrational spectroscopy in the temperature range of 16-180 K. During thermal annealing of the samples, characteristic vibrational C-H modes of methane were monitored alongside the chamber pressure to register both structural changes and desorption of the film material. The obtained results reveal that upon the co-deposition of methane and water, methane molecules appear both in non-bound and trapped states. The observed broadening of the characteristic C-H stretching mode at 3010 cm(-1) upon an increase in temperature of the sample from 16 to 90 K, followed by narrowing of the peak as the temperature is reduced back to 16 K, indicates localization of methane molecules within the water matrix at lower temperatures.}, language = {en} }