Results 201 to 210 of about 18,272 (254)

Photophysical Properties of Free, Zinc‑, and Pyridine- Chlorin e6 Trimethyl Ester: A Computational Study with Vibrational Effects. [PDF]

ACS Omega
Suárez Ruiz MD, Daza MC, Doerr M.
europepmc   +1 more source

Resolving Oxidative and Corrosive Calendar‐Aging via Electrolyte Engineering for Stable Lithium Metal Batteries

Advanced Energy Materials, EarlyView.
A weakly solvating ether solvent, 1,2‐dimethoxypropane (DMP), is proposed for use in localized high‐concentration electrolytes (LHCEs) for lithium metal batteries (LMBs). These DMP‐based LHCEs simultaneously suppress lithium metal corrosion and cathode degradation—two interrelated processes that accelerate calendar aging of LMBs.
Jisub Kim, Ihnkyung Jung, Kyunam Lee, Insu Hwang, Minkwan Kim, Eunseok Park, Dongmin Park, Hayoung Park, Yonggoon Jeon, Gaeun Park, Hyo Chul Ahn, Jihoon Oh, Jungwon Park, Ali Coskun, Jang Wook Choi   +14 more
wiley   +1 more source

Photodegradation of indigo carmine over a (BiO)₂CO₃@ZnCo₂O₄ heterojunction: experimental and DFT insights. [PDF]

Nanoscale Adv
Tho NTM, Thang NQ, Tran Nguyen MA, Anh NTH, Kim Phung NL.   +4 more
europepmc   +1 more source

Synthesis, X-Ray Analysis, Anticancer Activity, Computational, and in Silico Studies of New Thiophene Pyrazole Conjugates. [PDF]

ChemistryOpen
Muhsinah AB, Kheder NA, Elhaty IA, Mabkhot YN.   +3 more
europepmc   +1 more source

Toxicological investigation of mycotoxin contaminants and antibiotic residues associated with the poultry industry and their impact on human health. [PDF]

RSC Adv
Akter J, Hossain K, Nath SD, Islam H, Afrin K, Begum H, Uzzaman M.   +6 more
europepmc   +1 more source

HOMO-LUMO gaps of armchair carbon nanotubes with Stone-Wales defect

Proceedings of the Symposium on Chemoinformatics, 2011
openaire   +1 more source

Combining DFT Calculations and Clustering Techniques to Screen Organic Monovalent Cations for Applications in Halide Perovskite Solar Cells. [PDF]

ACS Omega
Bueno GC, Ribeiro IC, Ornelas-Cruz I, Prati RC, Lima MP, Da Silva JLF.   +5 more
europepmc   +1 more source

A C₆₆ Polycyclic Aromatic Hydrocarbon with Six Azulene Units and NIR-II Absorption: Toward Azulene-Based Carbon Allotropes. [PDF]

J Am Chem Soc
Borkowski M, Drwęcka A, Zelewski SJ, Kasprzak A, Szafert S, Pigulski B.   +5 more
europepmc   +1 more source

DFT insights into the photovoltaic performance of A-π-A non-fullerene acceptors for organic solar cells. [PDF]

Sci Rep
Khan M, Sarwar F, Gull K, Arshad M, Shafiq I, Arshad MN, Alzahrani KA, Jawaria R.   +7 more
europepmc   +1 more source

Molecular insights into the effect of small molecule impurities in the ring-opening polymerization of [PCl₂N]₃ using quantum mechanical analysis.

Phys Chem Chem Phys
Xue Y, Salmon CR, Gogonea V.
europepmc   +1 more source