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Category: Chemical Physics

Electronic, elastic and piezoelectric properties calculations of perovskites materials type BiXO<sub>3</sub>(X=Al, Sc): DFT and DFPT investigations

Electronic, elastic and piezoelectric properties calculations of perovskites materials type BiXO<sub>3</sub>(X=Al, Sc): DFT and DFPT investigations

Publication date: Available online 16 June 2023Source: Chemical PhysicsAuthor(s): RACHEDI Samia, AZZAZ Yahia, BENAMARA Ahmed, BERRAHAL Mokhtar, MOULAY Noureddine, LIANI Mohamed, BENSAID Djillali, Y. Al-Douri

Modulation of contact types and Schottky barrier in Ti<sub>3</sub>C<sub>2</sub>T<sub>2</sub>/TiSi<sub>2</sub>N<sub>4</sub> (T = O or OH) van der Waals heterostructures by biaxial strain and external electric field

Modulation of contact types and Schottky barrier in Ti<sub>3</sub>C<sub>2</sub>T<sub>2</sub>/TiSi<sub>2</sub>N<sub>4</sub> (T = O or OH) van der Waals heterostructures by biaxial strain and external electric field

Publication date: Available online 15 June 2023Source: Chemical PhysicsAuthor(s): Zijian Zhang, Jiahui Wang, Zheng Dai, Mingyi Zhang, Li Niu, Lina Bai

An experimental and theoretical exploration of the impact of co-solvent on the micellization behaviour of ionic surfactants

An experimental and theoretical exploration of the impact of co-solvent on the micellization behaviour of ionic surfactants

Publication date: Available online 15 June 2023Source: Chemical PhysicsAuthor(s): Ishrat Fatma, Vivek Sharma, Praveen Kumar Sharma, Plinio Cantero-López, Humira Assad, Julio Sánchez, Melissa Alegría-Arcos, Osvaldo Yañez, Ramesh Chand Thakur, Ashish Kum…

Elucidating the Binding Mechanism between Bovine Serum Albumin and TiO<sub>2</sub> Nanoparticles with Diverse Properties: Insights from Spectroscopic Methods and Molecular Docking Simulation

Elucidating the Binding Mechanism between Bovine Serum Albumin and TiO<sub>2</sub> Nanoparticles with Diverse Properties: Insights from Spectroscopic Methods and Molecular Docking Simulation

Publication date: Available online 15 June 2023Source: Chemical PhysicsAuthor(s): Tingting Zhang, Haoming Chen, Chunhu Tan, Luo Li, Libin Zhang, Chang Liu, Weihua Li, Changqing Yan, Jiansheng Li, Rui Lu