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 6013-6024 of 9,538

Expansive Quantum Mechanical Exploration of Chemical Reaction Paths

Alberto Baiardi, Stephanie A. Grimmel, Miguel Steiner, Paul L. Türtscher, Jan P. Unsleber, Thomas Weymuth, Markus Reiher

2021 Crossref Accounts of Chemical Research

Experimental measurement of kinetic parameters using quantum plasmonic sensing

K. T. Mpofu, C. Lee, G. E. M. Maguire, H. G. Kruger, M. S. Tame

2021 arXiv arXiv preprint

Exploiting fermion number in factorized decompositions of the electronic structure Hamiltonian

Sam McArdle, Earl Campbell, Yuan Su

2021 arXiv arXiv preprint

Exploration of efficient electron acceptors for organic solar cells: rational design of indacenodithiophene based non-fullerene compounds

Muhammad Khalid, Muhammad Usman Khan, Eisha-tul -Razia, Zahid Shafiq, Mohammed Mujahid Alam, Muhammad Imran, Muhammad Safwan Akram

2021 DOAJ Scientific Reports

Exploring variational quantum eigensolver ansatzes for the long-range XY model

Jia-Bin You, Dax Enshan Koh, Jian Feng Kong, Wen-Jun Ding, Ching Eng Png, Lin Wu

2021 arXiv arXiv preprint

Exposing minimal composition of Kohn-Sham theory and its extendability

H. Nakada

2021 arXiv arXiv preprint

Fano Resonances in Quantum Transport with Vibrations

Ajith Ramachandran, Michael Genkin, Auditya Sharma, Alexander Eisfeld, Sebastian Wüster, Jan-Michael Rost

2021 arXiv arXiv preprint

Features of model thin-film solar cells photoelectric characteristics based on a non-toxic multi-component connection CuZn2AlS4

D. Sergeyev, K. Shunkeyev, B. Kuatov, N. Zhanturina

2021 DOAJ Eurasian Journal of Physics and Functional Materials

Flexibility of the factorized form of the unitary coupled cluster ansatz

Jia Chen, Hai-Ping Cheng, J. K. Freericks

2021 arXiv arXiv preprint

Fluorescence Quenching Probe Based on Graphene Quantum Dots for Detection of Copper Ion in Water

Sutthipoj Wongrerkdee, Pichitchai Pimpang

2021 Crossref Integrated Ferroelectrics

Formation of CdSe/CdS/ZnS Quantum Dots Floating Monolayers on the NiCl2 Containing Subphase

A. J. Al- Alwani, V. N. Mironyuk, A. J. Al-Hassani, N. N. Begletsova, M. V. Pozharov, A. I. Smirnova, N. V. Usol'tseva, E. G. Glukhovskoy

2021 Crossref Liquid Crystals and their Application

Functional Tensor-Train Chebyshev Method for Multidimensional Quantum Dynamics Simulations

Micheline B. Soley, Paul Bergold, Alex A. Gorodetsky, Victor S. Batista

2021 arXiv arXiv preprint