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 1345-1356 of 3,656
Modulation of the 1D/2D Dimensionality by Ligand Exchange in a Series of Cu- and Ag-Naphthalenethiolate Coordination Polymers: Effect on Conductivity and Photoemission.
Giraudon A, Xu B, Andrade C, Autran L, Bonhommé A, Puzenat E, Monge M, Ledoux G, Guillou N, Perret F, Pailhès S, Demessence A
Molecular based spin qubits of Mn(II) coordination compounds with S = 5/2.
Wakizaka M, Yamashita M
Molecular Design of Chiral Naphthalenediimide-Based Cations for Chiral One-Dimensional Metal Halide Semiconductors with Strong Chiroptical Activity and Amplified Charge Transport Ability.
Zhang X, Ramakrishnan S, Hu X, Xie Y, Xu Y, Babatunde A, Alphenaar AN, Yin X, Zheng X, Li L, Liu P, Li H, Zhang Y, Cotlet M, Jiang S, Mitzi DB, Yu Q
Molecular Dioxygen-Mediated Passivation of Electron Traps in n-Type Organic Charge-Transfer Complexes.
Gubanov KK, Reva Y, Ritterhoff CL, Candolfi F, Langford D, Herm M, Franz E, Crisp RW, Hampel F, Krieger M, Späth A, Watts B, Libuda J, Weber HB, Meyer B, Guldi DM, Fink RH
Molecular Dispersion of Conjugated Polymers via Amine Containing Additives Facilitates Coating and Preserves Solid State Emission.
Keleş B, Sema F, Bozkurt Y, Yağmurcukardeş M, Yildiz UH
Molecular docking of the DREB(A-6) group and enhanced thermotolerance in potato by overexpressing the DREB(A-6) gene.
Azeem S, Munir F, Amir R, Gul A
Molecular docking, MM/GBSA, FEP/MD, and DFT/MM MD studies on predicting binding affinity of carbonic anhydrase II inhibitors.
Shimizu R, Takano Y, Saito T
Molecular dynamics study of M-Trifluoromethyl diphenyl diselenide binding to the μ-opioid receptor: A computational perspective on morphine-induced tolerance.
Sardar M, Ahmad N, Huzaifa M, Mushtaq M, Nur-E-Alam M, Sun P, Ul-Haq Z
Molecular electronic chirality in copper phthalocyanine induced via twisted π-π stacking on bilayer graphene.
Qin HJ, Sun RJ, Liu JJ, Liao WA, Wang DB, Yu J, Leng TH, Liu CF, Zhang WH, Fu YS
Molecular Engineering of Asymmetric Cyanines with Hybridized Local and Charge-Transfer Characteristics for NIR-II Imaging-Guided Type I/II Photodynamic Therapy.
Yang R, Wen Y, Wang T, Gao R, Xu H, Chen R, Wang H, Li L, Zhang R
Molecular Engineering of Vibronic Coupling Enables High-Temperature Solar-Thermal Conversion in an Organic Material.
Xu H, Liu Y, Jiang X, Han P, Wang W, Zhou W, Song B, Zhai Y, Hu B, Qin A, Tang BZ
Molecular engineering via C=N imine bridge and heterocycle modulation: Constructing red-emissive quinolinium probes for ratiometric and high-fidelity detection and imaging of bisulfite.
Wu CY, Liu N, Ma Z, Liang T, Tian M, Li Y, Zhong K, Tang L, Yan X