91. Adaptive Evolution of Peptide Inhibitors for Mutating SARS‐CoV‐2. Issue 12 (8th October 2020) Authors: Chaturvedi, Parth; Han, Yanxiao; Král, Petr; Vuković, Lela Journal: Advanced theory and simulations Issue: Volume 3:Issue 12(2020) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
92. Adiabatic Connection for Range‐Separated Hybrid Functionals. Issue 4 (12th February 2022) Authors: Garrick, Rachel; Kronik, Leeor; Gould, Tim Journal: Advanced theory and simulations Issue: Volume 5:Issue 4(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
93. Adsorption Mechanism and Optical Behaviors of Typical Volatile Organic Compounds on Pristine and Cu/Ni‐Modified C3N Monolayer: A First‐Principles Study. Issue 1 (11th November 2022) Authors: Ma, Kexin; Wang, Yanwen; Zheng, Yunxin; Xiao, Jianrong; Xu, Liang; Dai, Xueqiong; Wang, Zhiyong Journal: Advanced theory and simulations Issue: Volume 6:Issue 1(2023) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
94. Adsorption of SF6 Decomposed Species on Ti3C2O2 and Ti3C2F2 with Point Defects by DFT Study. Issue 7 (4th June 2021) Authors: Kong, Lingyan; Liang, Xiongyi; Deng, Xiangxuan; Guo, Chen; Wu, Chi‐Man Lawrence Journal: Advanced theory and simulations Issue: Volume 4:Issue 7(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
95. Adsorption of Water Molecules on Pristine and Defective NiPX3 (X: S, Se) Monolayers. Issue 11 (3rd October 2021) Authors: Wu, Zhicheng; Xu, Sifan; Zhou, Yong; Guo, Qilin; Dedkov, Yuriy; Voloshina, Elena Journal: Advanced theory and simulations Issue: Volume 4:Issue 11(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
96. Advanced Theory and Simulations in 2022 – Growing in Volume and Breadth. Issue 1 (10th January 2023) Authors: Spiegel, Stefan; Bahrs, Sabine Journal: Advanced theory and simulations Issue: Volume 6:Issue 1(2023) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
97. Advent of Cross‐Scale Modeling: High‐Performance Computing of Solidification and Grain Growth. Issue 9 (5th July 2018) Authors: Shibuta, Yasushi; Ohno, Munekazu; Takaki, Tomohiro Journal: Advanced theory and simulations Issue: Volume 1:Issue 9(2018) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
98. Aerodynamic and Acoustic Simulations of Thick Flatback Airfoils Employing High Order DES Methods. Issue 8 (12th May 2022) Authors: Bangga, Galih; Seel, Ferdinand; Lutz, Thorsten; Kühn, Timo Journal: Advanced theory and simulations Issue: Volume 5:Issue 8(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
99. Aerogel: Numerical Study on the Thermal and Optical Performances of an Aerogel Glazing System with the Multivariable Optimization Using an Advanced Machine Learning Algorithm (Adv. Theory Simul. 9/2019). Issue 9 (5th September 2019) Authors: Zheng, Siqian; Zhou, Yuekuan Journal: Advanced theory and simulations Issue: Volume 2:Issue 9(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
100. Air Quality Index Prediction Based on an Adaptive Dynamic Particle Swarm Optimized Bidirectional Gated Recurrent Neural Network–China Region. Issue 12 (28th October 2021) Authors: Li, Ping; Wang, Shengwei; Ji, Hao; Zhan, Yulin; Li, Honghong Journal: Advanced theory and simulations Issue: Volume 4:Issue 12(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗