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 4813-4824 of 9,538
Spectral function of a bipolaron coupled to dispersive optical phonons
K. Kovač, J. Bonča
Spectral, experimental-toxicological and quantum-chemical studies of predictors of biological activity of titanium-containing nanoparticles doped with silver
O. P. Yavorovskyi, A. V. Ragulya, V. M. Riabovol, A. I. Kurchenko, N. I. Tyshchenko, M. M. Zahornyi, O. V. Filonenko, V. V. Lobanov, V. V. Lobanov, S. D. Zahorodnia, L. O. Artiukh
Spectroscopic footprints of quantum friction in nonreciprocal and chiral media
O. J. Franca, Fabian Spallek, Steffen M. Giesen, Robert Berger, Kilian Singer, Stefan Aull, Stefan Yoshi Buhmann
Spectroscopic, <scp>DFT</scp>, In Silico, and Estimation of Biological Activity of 2,4‐Dichloro‐6,7‐Dimethoxyquinazoline as a Potential Anti‐Alzheimer's Disease Therapeutic Agent
Karthikeyan Asokan, Sumathi Sivaraman, Karthik Nallasamy, Jeyavijayan Subbiah, Selvarengan Paranthaman
Spin correlation in two-proton emission from $^6$Be
Tomohiro Oishi
Spin migration in density functional theory: energy, potential and density perspectives
Alon Hayman, Eli Kraisler, Tamar Stein
Spin torque driven electron paramagnetic resonance of a single spin in a pentacene molecule
Stepan Kovarik, Richard Schlitz, Aishwarya Vishwakarma, Dominic Ruckert, Pietro Gambardella, Sebastian Stepanow
Spin-bearing molecules as optically addressable platforms for quantum technologies.
Kuppusamy SK, Hunger D, Ruben M, Goldner P, Serrano D.
Spin-Symmetry Projected constrained Unrestricted Hartree-Fock
Amir Ayati, Hugh G. A. Burton, Stijn De Baerdemacker
Spin/Phonon Dynamics in Single Molecular Magnets: I. quantum embedding
Nosheen Younas, Yu Zhang, Andrei Piryatinski, Eric R Bittner
Spin/Phonon Dynamics in Single Molecular Magnets: II. spin/phonon entanglemen
Nosheen Younas, Yu Zhang, Andrei Piryatinski, Eric R Bittner
Stabilizer configuration interaction: Finding molecular subspaces with error detection properties
Abhinav Anand, Kenneth R. Brown