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 2017-2028 of 8,661
Quantum Chemistry-Driven Molecular Inverse Design of Stable Isomers with Data-Free Reinforcement Learning.
Calcagno F, Serfilippi L, Franceschelli G, Garavelli M, Musolesi M, Rivalta I
Quantum Coherence in a Perylene-Based Metal–Organic Framework for Potential Solid-State Qubits
Chanchal Rani, Hochul Woo, Elizabeth Goodson, Juan S. Sandoval, Jonathan R. Palmer, Leila M. Foroughi, Adam J. Matzger, Michael R. Wasielewski, Theodore Goodson
Quantum Computing and AI’s Role in Shaping the Future of Carbon Emissions
Yurukcu M, Nandakumar H, Khmurovich A.
Quantum Computing and Error Mitigation with Deep Learning for Frenkel Excitons
Yi-Ting Lee, Vijaya Begum-Hudde, Barbara A. Jones, André Schleife
Quantum Computing Beyond Ground-State Electronic Structure: A Review of Progress Toward Quantum Chemistry Out of the Ground State.
Bidart A, Vaish P, Kabengele T, Pang Y, Liu Y, Rubenstein BM.
Quantum computing for accurate large-scale electronic-structure calculations: DFT-embedded, post-processed quantum-selected configuration interaction
Tuan Minh Do, Yuichiro Yoshida, Tomoya Shiota, Wataru Mizukami
Quantum Computing for Electronic Circular Dichroism Spectrum Prediction of Chiral Molecules
Amandeep Singh Bhatia, Sabre Kais
Quantum confined one-dimensional lepidocrocite titanate catalyst for superior electrocatalytic oxygen evolution performance
Devraj Singh, Mohamed A. Ibrahim, Aidan McMoil, Gregory R. Schwenk, Joshua Snyder, Michel W. Barsoum
Quantum Confinement Effect in a Heteromorphic PbS/SnS(2) Superlattice Grown by Atomic Layer Deposition.
Shin DH, Daqiqshirazi M, Bahrami A, Lehmann S, Wolf D, Lubk A, Wrzesińska-Lashkova A, Vaynzof Y, Haider G, Brumme T, Nielsch K
Quantum corrections and multioccupancy in a semi-classical gas
Loris Ferrari
Quantum correlation and coherence in a mononuclear nickel-based molecular Magnet
S. Bhuvaneswari, R. Muthuganesan, R. Radha
Quantum correlations in molecular cavity optomechanics
E. Kongkui Berinyuy, D.R. Kenigoule Massembele, P. Djorwé, R. Altuijri, S. Abdel-Khalek, A.-H. Abdel-Aty, S.G. Nana Engo