Quantum Chemistry

3,656 papers from PubMed

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 1141-1152 of 3,656

Interplay of redox, double-layer, and quantum effects governing the capacitance in nitrogen-doped Ti(2)CT(x) MXene-based supercapacitors.

T S, Mathew V

2026 PubMed Physical chemistry chemical physics : PCCP

Interplay of Semicoordination and π-Hole Bonding: The Case of Cocrystals of Group 10 (Ni, Pd, Pt) Dithiocarbonate Complexes with 1,4-Diiodotetrafluorobenzene.

Stozharova MA, Suslonov VV, Gomila RM, Frontera A, Eliseeva AA

2026 PubMed International journal of molecular sciences

Interpretable machine learning and molecular simulations identify natural pancreatic lipase inhibitors and hydrophobic hotspot residues.

Zhao Y, Wang J, Yu S, Zhuo X, Li X, Chen Z, Liang G

2026 PubMed Bioorganic chemistry

Intracellular Oxygen Sensing Using Long-Phosphorescence-Lifetime Cationic Ir(III) Complexes With Coumarin 6 and 545T Ligands.

Horikoshi A, Hirose T, Shiozaki S, Yoshihara T

2026 PubMed Analytical chemistry

Intracellular Proton Enrichment Drives Unified Dual-Cofactor Regeneration for Biohybrid CO(2) Fixation.

Bian X, Qiu C, Yang B, Hou Y, Lei L, Li Z

2026 PubMed Angewandte Chemie (International ed. in English)

Intramolecular Charge-Transfer Dopants Enable Isolated Triplet Excitons as Spin Qutrits in a Single Crystal.

Han Y, Tyndall SB, Peinkofer KR, Huang Y, Young RM, Krzyaniak MD, Wasielewski MR

2026 PubMed Angewandte Chemie (International ed. in English)

Intramolecular energy transfer to S-nitrosylated Cys residues is at the basis of fluorescence sensitivity to nitric oxide in the blue fluorescent protein mTagBFP2.

Bellanova L, Viappiani C, Scarano A, Bruno S, Morreale K, Franzen A, Santiago-Schübel B, Cupellini L, Svensson V, Drepper T, Abbruzzetti S, Delcanale P, Laneri F, Sortino S, Di Fenza A, Nifosì R, Viappiani C, Gensch T

2026 PubMed International journal of biological macromolecules

Intramolecular exciton coupling modulates the convergent singlet-triplet energy gap toward NIR-emissive heavy-atom-free Oligo-BODIPY photosensitizers.

Pan C, Shao J, Kang Z, Lv F, Zhang X, Gao J, Xu X, Wei Y, Hao E, Jiao L

2026 PubMed Chemical science

Intramolecular quantum dynamics on intersecting potential energy surfaces: a tutorial review.

Köppel H, Nikoobakht B

2026 PubMed Physical chemistry chemical physics : PCCP

Intraparticle FRET probes based on dual-emission carbon dots for analytical detection of human hemoglobin and molecular docking analysis.

Zhang M, Guan Y, Wei Y

2026 PubMed Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Intrinsic and Water-Triggered Hydrophilicity in Tween 20-PDMS Composites for Dynamic and Long-Term Wettability Control.

Cha H, Trinh QT, Galogahi FM, Yadav S, Vu HH, Tran DT, Zhang J, An H, Nguyen NT

2026 PubMed Small (Weinheim an der Bergstrasse, Germany)

Intrinsic Charge-Carrier Transport Limitations in ZnFe(2)O(4) Revealed by Time-Resolved Microwave Conductivity.

Saini RK, Miriyala K, Chernykh D, Engel Y, Rashkovskiy A, Grave DA

2026 PubMed The journal of physical chemistry letters