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 1513-1524 of 9,662
Gomberg's Earlier "Instance of Trivalent Carbon".
Grainger C, Whittaker SJ, Desrosiers D, Lee SS, Shtukenberg AG, Kahr B
GPU implementation of mixed quantum-classical Liouville molecular dynamics without momentum jump
Koji Ando
GPU-Accelerated Host-Aware Dead-Measurement Detection in Hybrid Quantum--Classical Programs: Full Version
Yanbin Chen, Qunyou Liu, Yu Wang, Christian B. Mendl, Helmut Seidl
GPU-accelerated modeling of biological regulatory networks.
Reimer J, Saha P, Chen C, Dhar N, Byrns B, Rayan S, Broderick G
Gradients not needed: ML-driven propagation of nonadiabatic molecular dynamics without reference gradients.
Martyka M, Jankowska J, Lischka H, Dral PO
Grand-Canonical Typicality
Cedric Igelspacher, Roderich Tumulka, Cornelia Vogel
Graph Neural Networks for Fast Operator Selection in Adaptive VQE
Javad Vahedi, Hadi H. Arefi
Graph neural networks for molecular dynamics simulations.
Ahsan M, Pindi C, Sinha S, Patel AC, Palermo G
Graphene hybrid nanoprobes for targeted microbial sensing and ultralow-energy, deep-tissue, noninvasive multiphoton imaging in the NIR-I/II region.
Kuo WS, Lin YS, Chang CY, Wang JY, Chen PC, Tseng SW, Lin CY, Chang CC, Wu SR
Graphene quantum dot-enhanced Chemiluminescence sensor based on surface molecular imprinting recognition for the detection of Tetrabromobisphenol A.
Tong A, Xu N, Yan T, Chen F, Yang C
Graphene quantum dot–guided growth of dendritic gold nanostructures for ultrasensitive electrochemical detection of miRNA-9 using a DNA capture probe in spiked human serum
Sahar Jafarzadeh, Hossein Siampour, Abdollah Allahverdi, koosha Irani, Amir Bayat, Esmaiel Saievar-Iranizad
Graphene Quantum Dots as Electron Acceptor Tailoring S-Scheme Heterojunction Bi(2)MoO(6)@Cu(2)O for Highly Efficient Photocatalytic H(2) Evolution.
Ren M, Ye F, Luo J, Xie W, Ye J, He M, Qian J, Chen Q