Quantum Chemistry
9,662 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 1957-1968 of 9,662
Learning to Prepare Molecular Ground States with Transformer Models
Alex Koziell-Pipe, Jasmine Brewer, Jem Guhit, Marwa H. Farag, Kripa Panchagnula, Gabriel Laude, Fabian Finger, Carlo Gaggioli, Ludmila Szulakowska, Oliver J. Backhouse, Christos Papalitsas, Jason G. Mustakis, Thomas Soini, David Munoz Ramo, Stephen Clark, Elica Kyoseva, Enrico Rinaldi
Leveraging 3d-4f Coordination: Molecular Quantum Spring-Magnet Behavior in Axial Ni(2)Ln Complexes.
Jing Z, Moreno-Pineda E, Paul S, Sunil A, Fuhr O, Chen Y, Wernsdorfer W, Ruben M
Leveraging Pretrained Neural Network Models for the Classification of Tumor Cells Analyzed by Label-Free Phase Holotomographic Microscopy.
Losa LVC, Douglas TA, Santos L, Monteiro R, Calejo I, Canadas RF, Nieder JB
Leveraging the kinetic isotope effect by compact H-bond motifs for electrochemical hydrogen isotope separation.
Wen G, Liang H, Liu S, Zhang N, Chen S, Shen G, Wang T, Chen R, Tao L, Ren B, Wang S
LFaB: Low Fidelity as Bias for Active Learning in the Chemical Configuration Space.
Vinod V, Zaspel P
Lie-algebraic incompleteness of symmetry-adapted VQE for non-Abelian molecular point groups
Leon D. da Silva, Marcelo P. Santos
Ligand Confinement for Fast-Decay Cu─I Chain Scintillators Enabling High-Resolution X-ray Imaging and 3D Tomography.
Cao Q, Ye J, Li L, Li N, Xiao K, Zhu Y, Liang M, Liu S, Liu X, Zhao Q
Ligand engineering coupled with dual cross-linking enables high-performance, stable and photo-patternable perovskite quantum dots light-emitting diodes
Chih-Yu Chang, Marcin Słoma, Julius Griškevičius, Jakub Holovský
Ligand-Engineered Methylammonium Lead Bromide Nanoplatelets: Single-Photon Emission and Strong Light-Matter Coupling.
Sekh TV, Kim T, Sabisch S, Bertolotti F, Caliò L, Galisteo-López JF, Coto-Ruiz FJ, Santiago-Andrades L, Guagliardi A, Masciocchi N, Erni R, Miguez H, Rainò G, Bodnarchuk MI, Kovalenko MV
Ligand-field symmetry and magneto-optical correlations in a luminescent Dy(III) single-molecule magnet.
Kuppusamy SK, Pachl C, Jing Z, Paul S, Heinrich B, Fuhr O, Klyatskaya S, Wernsdorfer W, Powell AK, Fink K, Ruben M
Ligand-Mediated Surface Carrier Modulation in Perovskite Nanocrystals for Charge-Symmetric LEDs.
Park J, Ha J, Kim D, Kim HW, Lee HU, Je B, Kim D, Yeo JS, Kim MG, Cho C, Cho SB, Han TH
Ligand-to-Ligand Charge Transfer (LL'CT) Transitions in Square-Planar Metal-Bipyridyl Complexes of Heteroatom-Substituted Maltol Derivatives.
Usman MA, Adebanjo JO, French KA, Bruner BC, Lu Z, Klausmeyer KK, Shuford KL, Omary MA, Farmer PJ