Quantum Chemistry
9,538 papers
Quantum Chemistry Research Context
This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.
Showing 1105-1116 of 9,538
Elucidating the role of TPGS in felodipine/PVPVA amorphous solid dispersions during water uptake: dissipative particle dynamics simulations using quantum chemistry-based interaction parameters
Chinatsu Kobayashi, Naoko Konami, Yumika Ogura, Koji Okuwaki, Kenjirou Higashi, Motoki Inoue, Takefumi Yamashita, Takayuki Furuishi, Kaori Fukuzawa, Etsuo Yonemochi
Elucidating the scope and stereochemistry of Diels-Alder reactions of (E)- and (Z)-1,1,1,4,4,4-hexafluoro-2-butene: A combined NMR, quantum-chemical, and X-ray crystallographic study
Mikhail M. Kremlev, Oleksii I. Mushta, Andrii A. Kyrylchuk, Sergii Suikov, Eduard Rusanov, Svitlana Shishkina, Yurii L. Yaguposkii, Sheng Peng, Lee Sprague
Elucidating the Synergetic Interplay between Average Intermolecular Coupling and Coupling Disorder in Short-Time Exciton Transfer
Siwei Wang, Guangming Liu, Hsing-Ta Chen
Embankment protection-inspired interfacial engineering for ultrahigh-efficiency, stable tandem quantum dot light-emitting devices
Kuibao Yu, Zhihan Lin, Tian Liu, Haolin Luo, Chao Zhong, Hao Liu, Fushan Li, Hailong Hu
Embedded quantum computing for many-body surface reaction
Dedong Wan, Xiaopeng Li, Yi Fan, Jie Liu, Xiongzhi Zeng, Zhenyu Li
Emergence of a Fluctuating Ground State in Y-Kapellasite under Pressure.
Chatterjee D, Doležal P, Abbruciati F, Biesner T, Zoch KM, Khasanov R, Islam SS, Kaur G, Roh S, Capitani F, Rodrigues JEFS, Garbarino G, Krellner C, Mendels P, Kermarrec E, Dressel M, Wehinger B, Pustogow A, Bert F, Puphal P
Emerging haemostatic sprays: From material design to clinical translation.
Nepal A, Tran H, Nguyen NT, Ta HT
Emerging Nanomaterials for Advanced Water Decontamination: Opportunities and Challenges.
Kesarwani S, Tripathy DB, Verma R, Hung YT
Emission dipole orientation reveals dynamic single-molecule interactions with 2D crystals at solvent interfaces.
Guo W, Chen TH, Ronceray N, Mayner E, Watanabe K, Taniguchi T, Radenovic A
Emission in Closely Packed Eu (TTA) <sub>3</sub> (DPT) and Opportunities for Magnetic Dipole Enhancement
Ashleigh K. Wilson, John Munga, Chi Yang, Tigran V Shahbazyan, Ezekiel Mills III, Terence Baker, Md. G.R. Chowdhury, Mikhail A. Noginov, Natalia Noginova
Emissive Liquid Crystalline Boron C,N-Chelates: Synthesis, Self-assembly, and Photophysical Properties.
Müller F, Feucht F, Beck A, Seher R, Zens A, Kästner J, Molard Y, Laschat S
Emissive Room-Temperature Ionic Liquids Enabled by Dialkylphospholium-Based Tetracyclic Cores with Bulky Counter Anions.
Murai M, Kamegai S, Andoh K, Yamaguchi S