Sharma S R K C Yamijala

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 12

Top Topics

Reduced Graphene Oxide

Room Temperature

Molecular Dynamics

Top Venues

The journal of physical chemistry letters

Chemphyschem : a European journal of chemical physics and physical chemistry

Physical chemistry chemical physics : PCCP

Environmental science & technology

This page only lists publications with an associated author ORCID identifier.

Publications

Rahul Sahu, Sharma S R K C Yamijala, Kotagiri Venkata Rao, Sandeep K Reddy
Dispersion-Driven Cooperativity in Alkyl Perylene Diimide Oligomers: Insights from Density Functional Theory. Chemphyschem : a European journal of chemical physics and physical chemistry 25 (17) (2024)
Babuji Dandigunta, Abhijitha V G, Sharma S R K C Yamijala, B R K Nanda
α-Graphyne with ultra-low diffusion barriers as a promising sodium-ion battery anode and a computational scheme for accurate estimation of theoretical specific capacity. Nanoscale (2024)
Rahul Sahu, Sharma S R K C Yamijala, Kotagiri Venkata Rao, Sandeep K Reddy
Dispersion-Driven Cooperativity in Alkyl Perylene Diimide Oligomers: Insights from Density Functional Theory. Chemphyschem : a European journal of chemical physics and physical chemistry (2024)
Gaurav Vishwakarma, Bijesh K Malla, K S S V Prasad Reddy, Jyotirmoy Ghosh, Soham Chowdhury, Sharma S R K C Yamijala, Sandeep K Reddy, Rajnish Kumar, Thalappil Pradeep
Induced Migration of CO 2 from Hydrate Cages to Amorphous Solid Water under Ultrahigh Vacuum and Cryogenic Conditions. The journal of physical chemistry letters (2023)
Gaurav Vishwakarma, Bijesh K Malla, K S S V Prasad Reddy, Jyotirmoy Ghosh, Soham Chowdhury, Sharma S R K C Yamijala, Sandeep K Reddy, Rajnish Kumar, Thalappil Pradeep
Induced Migration of CO 2 from Hydrate Cages to Amorphous Solid Water under Ultrahigh Vacuum and Cryogenic Conditions. The journal of physical chemistry letters 14 (11) (2023)
Subhadeep Banerjee, Ankita Narwal, Sandeep K Reddy, Sharma S R K C Yamijala
Promising anode materials for alkali metal ion batteries: a case study on cobalt anti-MXenes. Physical chemistry chemical physics : PCCP (2023)
Kalpak Ghosh, Sumit Kumar, Nirmal Mammavalappil Rajan, Sharma S R K C Yamijala
Deep Neural Network Assisted Quantum Chemistry Calculations on Quantum Computers. ACS omega 8 (50) (2023)
Sohag Biswas, Sharma S R K C Yamijala, Bryan M Wong
Degradation of Per- and Polyfluoroalkyl Substances with Hydrated Electrons: A New Mechanism from First-Principles Calculations. Environmental science & technology 56 (12) (2022)
Pandeeswar Makam, Sharma S R K C Yamijala, Venkata S Bhadram, Linda J W Shimon, Bryan M Wong, Ehud Gazit
Single amino acid bionanozyme for environmental remediation. Nature communications 13 (1) (2022)
Sharma S R K C Yamijala, Hyuna Kwon, Juchen Guo, Bryan M Wong
Stability of Calcium Ion Battery Electrolytes: Predictions from Ab Initio Molecular Dynamics Simulations. ACS applied materials & interfaces 13 (11) (2021)
Sharma S R K C Yamijala, Pengfei Huo
Direct Nonadiabatic Simulations of the Photoinduced Charge Transfer Dynamics. The journal of physical chemistry. A 125 (2) (2021)
Sharma S R K C Yamijala, Giorgio Nava, Zulfikhar A Ali, Davide Beretta, Bryan M Wong, Lorenzo Mangolini
Harnessing Plasma Environments for Ammonia Catalysis: Mechanistic Insights from Experiments and Large-Scale Ab Initio Molecular Dynamics. The journal of physical chemistry letters 11 (24) (2020)