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 565-576 of 8,661
Counterdiabatic ADAPT-VQE for Molecular Simulation.
Tancara D, Díaz-Moraga H, Goyeneche D
Coupled Electronic and Structural Evolution in Materials Probed by Tabletop Femtosecond Coherent XUV Absorption Spectroscopy.
Kumar V, Dharmadhikari AK, Biswas S
Coupling between Thermochemical Contributions of Subvalence Correlation and of Higher-Order Post-CCSD(T) Correlation Effects─A Step toward "W5 Theory".
Barman A, Jones GH, Weflen KE, Shepelenko M, Martin JML
Covalent Bond Locking in Semiconducting Oligomers Boosts Ultrabright NIR-II Luminescence for Deep Brain Theranostics.
Li X, Gan H, Zhang C, Gao Y, Zhang J, Su Z, Zhao Q, Feng Z, Zhong J, Wang H, Cen C, Li N, Wang Y, Qiu P, Wang K, Qian J, Li S
Covalent organic frameworks for ratiometric fluorescent monitoring copper corrosion in tin bronze.
Lu H, Guan C, Guo L
CovAngelo: A hybrid quantum-classical computing platform for accurate and scalable drug discovery
Linn Evenseth, Kamil Galewski, Witold Jarnicki, Piero Lafiosca, Vyom N. Patel, Grzegorz Rajchel-Mieldzioć, Martin Šimka, Michał Szczepanik, Emil Żak
Creating and Probing Spin-Squeezed States of Molecules
Connor M. Holland, Callum L. Welsh, Yukai Lu, David Wellnitz, Xing-Yan Chen, Ana Maria Rey, Lawrence W. Cheuk
Creation and precise spectroscopy of $^{86}$Sr$_2$ halo molecules
Brandon Iritani, Jingjing Huang, Wenwei Xu, Gisung Sim, Robert Moszynski, Tanya Zelevinsky
CRISPR/Cas13a-Driven Catalytic Hairpin Assembly of a Quantum Dot Nanobeacon for Viral RNA Detection
Yeling Yang, Yucheng Liu, Hui Xu, Fuxiang Zhou, Xinghu Ji, Zhike He
Critical evaluation of two neutron structures of Mn superoxide dismutase with quantum refinement.
Lundgren KJM, Bergmann J, Oksanen E, Ryde U
Critical point search and linear response theory for computing electronic excitation energies of molecular systems. I. General framework, application to Hartree-Fock and DFT.
Grazioli L, Hu Y, Cancès E
Cross-hatch strain effects on SiGe quantum dots for qubit variability estimation
Peña LF, Brickson MI, Rovaris F, Dycus JH, McDonald A, Piontkowski ZT, Ruzindana JB, Bradicich AM, Bethke D, Scott R, Beechem TE, Montalenti F, Jacobson NT, Bussmann E.