Quantum Chemistry
8,661 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 433-444 of 8,661
Chemical Information From the Ehrenfest Force Field Based on Reduced Density Matrix Functional Theory.
Mortera-Carbonell AJ, Hernández-Trujillo J, Francisco E, Pendás AM
Chemical Structure and Electronic Properties of Thermally Altered Coals: Insights from Multi-Technique Analysis and Modeling.
Mu R, Zhao Y, Shang X, Wang X
Chemical tuning of magnetic ordering and cryogenic magnetocaloric response in zircon-type Gd1-xErxVO4
Ming Zeng, Muqing Su, Liang Ming, Xiaolong Yang, Wang Chen, Lingwei Li, Hai-Feng Li
Chemical-Modification-Triggered Emergence of Phosphorescence in o-Carborane-Fused Benzophospholes.
Jia C, Wang C, Shan Z, Wang L, Duan Z
Chemically decisive benchmarks on the path to quantum utility
Srivathsan Poyyapakkam Sundar, Vibin Abraham, Bo Peng, Ayush Asthana
ChemRefine: An Open-Source Automated and Interoperable Platform for Machine Learning and Quantum Chemistry Simulations.
Migliaro I, Weiss MGS, Sterling AJ
Chiral Carbon Quantum Dots with High-Specificity Report Function as Efficient Antimicrobial Nanoagent to Resist Antibiotic Resistance
Lina Wu, Xiaoyun Lin, Lingxuan Sun, Jinpin Zhang, Jinxi Liu, Shuixin Liang, Wei Luo, Jiaxin Xue, Yujun Wen, Tiantian Wang, Ailin Liu, Yong Diao, Xianquan Feng, Liqing Lin
Chiral discrimination on gate-based quantum computers
Muhammad Arsalan Ali Akbar, Sabre Kais
Chiral multinary quantum dots through composition control: Toward next-generation semiconductor nanomaterials.
Branzi L, Ciotti A, Kavanagh A, Feehily E, García-Melchor M, Gun'ko YK
Chiral-Induced Spin Selectivity Regulates Triplet formation in Heliobacterial Photosynthesis
Parul Raghuvanshi, Vishvendra Singh Poonia
Chiral-Induced Spin-Polarized Molecular Switching in a Magneto-Controlled 2D System using Electrical Readouts.
Lei Y, Campos-Lendínez Á, Spasojevic I, Sala X, García-Antón J, Sort J, Muñoz J
Chirality Induced in Tetraethyllead through Noncovalent Interactions with a Chiral Tag.
Sun W, Giesen SM, Berger R, Schnell M