Quantum Chemistry
440 papers for year 2021
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 121-132 of 440
Electric field dependence of complex-dominated ultracold molecular collisions
Goulven Quéméner, James F. E. Croft, John L. Bohn
Electrochemical and quantum chemical study to assess the role of (2E)-2-(furan-2-ylmethylidene) hydrazine carbothioamide as inhibitor for acid corrosion of mild steel
V. R. Adinarayanan, P. Preethi Kumari, Suma A. Rao
Electrochemical Potential of the Metal Organic Framework MIL-101(Fe) as Cathode Material in Li-Ion Batteries
Fatemeh Keshavarz, Marius Kadek, Bernardo Barbiellini, Arun Bansil
Electron tunneling in the germanium/silicon heterostructure with germanium quantum dots: theory
Chuiko Institute of Surface Chemistry of National Academy of Sciences of Ukraine, S. I. Pokutnyi, N. G. Shkoda, Chuiko Institute of Surface Chemistry of National Academy of Sciences of Ukraine
Electronic quantum trajectories with quantum nuclei
Axel Schild
Elucidating the local atomic and electronic structure of amorphous oxidized superconducting niobium films
Thomas F. Harrelson, Evan Sheridan, Ellis Kennedy, John Vinson, Alpha T. N'Diaye, M. Virginia P. Altoé, Adam Schwartzberg, Irfan Siddiqi, D. Frank Ogletree, Mary C. Scott, Sinéad M. Griffin
ElVibRot-MPI: parallel quantum dynamics with Smolyak algorithm for general molecular simulation
Ahai Chen, André Nauts, David Lauvergnat
Emergence of Anyons on the Two-Sphere in Molecular Impurities
Morris Brooks, Mikhail Lemeshko, Douglas Lundholm, Enderalp Yakaboylu
Emerging quantum computing algorithms for quantum chemistry
Mario Motta, Julia Rice
Enantio-specific state transfer for symmetric-top chiral molecules
Bo Liu, Chong Ye, C. P. Sun, Yong Li
Enantiodetection of chiral molecules via two-dimensional spectroscopy
Mao-Rui Cai, Chong Ye, Hui Dong, Yong Li
Enantiosensitive steering of free-induction decay
Margarita Khokhlova, Emilio Pisanty, Serguei Patchkovskii, Olga Smirnova, Misha Ivanov