Quantum Chemistry
9,662 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 3937-3948 of 9,662
Basis Adaptive Algorithm for Quantum Many-Body Systems on Quantum Computers
Anutosh Biswas, Sayan Ghosh, Ritajit Majumdar, Mostafizur Rahaman, Manoranjan Kumar
Benchmarking Proton Tunneling Splittings with a Wavefunction-Based Double-Well Model: Application to the Formic Acid Dimer
Krishna Kingkar Pathak
Benchmarking the Impact of Active Space Selection on the VQE Pipeline for Quantum Drug Discovery
Zhi Yin, Xiaoran Li, Zhupeng Han, Shengyu Zhang, Xin Li, Zhihong Zhang, Runqing Zhang, Anbang Wang, Xiaojin Zhang
Benchmarking VQE Configurations: Architectures, Initializations, and Optimizers for Silicon Ground State Energy
Zakaria Boutakka, Nouhaila Innan, Muhammed Shafique, Mohamed Bennai, Z. Sakhi
Bio-inspired modification of nanocellulose based on in-situ homogeneous radical coupling of coniferin.
Wu S, Wang L, Li S, Wang Y, Lei S, Tang J, Cui J, Bian X, Jiang J, Zhang Y
Boltzmann to Lindblad: Classical and Quantum Approaches to Out-of-Equilibrium Statistical Mechanics
Stefano Giordano, Giuseppe Florio, Giuseppe Puglisi, Fabrizio Cleri, Ralf Blossey
Broadband Emission of Photoluminescence from Type‐II Quantum Wells Applied to Superluminescent Diodes
Hikaru Nakano, Takumi Yanagimoto, Koichiro Kunitake, Rikuto Takashima, Takeshi Fujisawa, Koji Maeda, Masakazu Arai
Broadly Tunable Quantum Enhanced Raman Microscopy for Advancing Bioimaging
Dmitrii Akatev, Yijian Meng, Jonathan Brewer, Maria Chekhova, Ulrik L. Andersen, Mikael Lassen
Brussonol and komaroviquinone as inhibitors of the SARS-CoV-2 Omicron BA.2 variant spike protein: A molecular docking, molecular dynamics, and quantum biochemistry approach.
Santos SJM, Valentini A
Capturing Protein Free Energy Landscape using Efficient Quantum Encoding
Ashwini Kannan, Jaya Vasavi Pamidimukkala, Avinash Dakshinamoorthy, Soham Bopardikar, Kalyan Dasgupta, Sanjib Senapati
Casimir Arc Plate Geometry: Computational Analysis of Thickness Constraints for Gold and Silver Nanomembranes in MEMS Applications
Anna-Maria Alexandrova, Jesus Valdiviezo
Cavity Ring-down Spectroscopy with behavior of Hybrid Cavity Structures
Muhammad Junaid Khan, Rida Batool Sheraliyat