Category Archives: Chemical Physics Letters

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Haixia Li, Zhihui Li, Leying Jin, Yun Zhang, Anchao Zhang, Zhijun Sun Continue reading Effect of Mn content in Mn_2−2yCo_yCr_yO_x catalyst on catalytic performance for SCR at low temperature→

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Rafaela M. D-S. Freitas, Clebio S. Nascimento, Camilla F. Silva Continue reading Nitenpyram-imprinted polymer: A theoretical investigation→

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Aline de Oliveira, Sabrina Grigoletto, Larissa Fernanda Menezes Alves Vieira, Sarah Júlia Fernandes Amorim, Heitor Avelino De Abreu Continue reading Unveiling the adsorption mechanism of arsenic species in the MOF-74 through an <em>in-silico</em> approach targeting the development of adsorbents for polluted water treatment→

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Xiaoyue Yang, Shuang Xu, Lisheng Liu, Zhihong Chen, Jili Liu Continue reading Atomistic simulation on the nano-scale oxidation of Fe-Cr alloy surfaces and the diffusion behavior of oxygen→

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Ngo Thi Lan, Nguyen Thi Mai, Duong Duc La, Son Tung Ngo, Nguyen Minh Tam, Nguyen Van Dang, Nguyen Thanh Tung Continue reading Exploring hydrogen adsorption on nanocluster systems: Insights from DFT calculations of Au<math xmlns:mml=”http://www.w3.org/1998/Math/MathML” altimg=”si194.svg” display=”inline” id=”d1e1300″ class=”math”><mrow><msub><mrow></mrow><mrow><mn>9</mn></mrow></msub><msup><mrow><mi>M</mi></mrow><mrow><mn>2</mn><mo>+</mo></mrow></msup></mrow></math> (<math xmlns:mml=”http://www.w3.org/1998/Math/MathML” altimg=”si54.svg” display=”inline” id=”d1e1319″ class=”math”><mi>M</mi></math> = Sc-Ni)→

Publication date: 16 November 2023Source: Chemical Physics Letters, Volume 831Author(s): Yan Chen, Xiangkun Wu, Tongpo Yu, Xiaoguo Zhou, Bing Yan, Shilin Liu Continue reading Theoretical re-investigation on the N–N bond breaking of N₂O⁺ cations in the A²Σ⁺ and B²Π states at the CASPT2 level→

Publication date: November 2023Source: Chemical Physics Letters, Volume 830Author(s): Keita Ikeue, Yuka Miyamoto, Erika Ando Continue reading Metal-substituted layered Fe-based oxides as a solid base catalyst→

Publication date: November 2023Source: Chemical Physics Letters, Volume 830Author(s): Hongru Zhou, Shuang Liu, Hao Yi, Shaoxian Song, Feifei Jia Continue reading Flotation of bastnaesite by mixed collectors and adsorption mechanism→

Publication date: November 2023Source: Chemical Physics Letters, Volume 830Author(s): R. Kacimi, E. Tanıs, A. Azaid, Y. Khaddam, M. Raftani, S. Sarfaraz, L. Bejjit, M. Bouachrine Continue reading Benzodithiophene-based Acceptor-Donor-Acceptor-type compounds for highly efficient organic photovoltaic cells→

Publication date: November 2023Source: Chemical Physics Letters, Volume 830Author(s): Guan-Hong Liu, Qun-Chao Ding, Chao-Wen Wang, Chun-Sheng Jia Continue reading Unified explicit formulations of thermodynamic properties for the gas NO₂, and gaseous BF₂ and AlCl₂ radicals→