Quantum Chemistry
9,538 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 1693-1704 of 9,538
Improving Efficiency and Color Purity of Blue Top-Emitting Organic Light-Emitting Diodes: Distributed Bragg Reflectors for Surface Plasmon Polariton Suppression and Cavity-Resonance Enhancement.
Park JY, Kang KC, Lee JS, Bi JC, Hwang S, Kil J, Kwon JH, Lim H, Park YW, Ju BK
Improving Generalization and Trainability of Quantum Eigensolvers via Graph Neural Encoding
Jungyun Lee, Daniel K. Park
Improving Perturbation Theory with the Sum-of-squares II: Large Density-Density Terms
Matthew B. Hastings
Improving the Stability and Efficiency of Blue Organic Light-Emitting Diodes via Remote tert-Butyl Modification on a Pt(II) complex.
Dai Y, Pan J, Chu Y, Qian Q, Li X, Wang Y, Wang W, Xia Q, Zhang C, Hang XC
Improving the Stability and Transferability of Effective ADMET Models by Adding Quantum Mechanical Descriptors.
Bose A, Anselmetti GR, Degroote M, Moll N, Santagati R, Streif M, Weskamp N, Tkatchenko A
In silico approach towards nanostructuring of dysprosium bis(amide)-alkene based single-ion magnet onto 1D, 2D, and 3D Network.
Kumari K, Singh SK
In silico identification of a prognostic gene signature and virtual screening for hepatocellular carcinoma.
Amin A, Fatima S, Aslam MK, Belaidi M, Bibi S, Bufarwa SW, Zahid S, Albadrani GM, Altalhi R, Sayed AA, Abdel-Daim MM
In silico identification of quinoline-pyridine hybrids binding to Mycobacterium protein kinase B, assessment by molecular dynamics simulation and quantum mechanics calculation, and in vitro validation of antimicrobial activity.
Saiki K, Yokota M, Yamamura S, Moriyama K, Morita S, Aoki S.
In silico profiling of commonly used insecticides, herbicides, and fungicides in Asia: a comparative chemical and toxicological study.
Zaman F, Kundu C, Debnath R, Avi AS, Ahmed E, Uzzaman M
In Situ Composition and Thickness Monitoring during (Bi <sub>x</sub> In <sub>1-x</sub> ) <sub>2</sub> Se <sub>3</sub> Thin Film Growth: toward Automated Synthesis Control Using Spectroscopic Ellipsometry for Quantum and Spintronic Devices
Maria Hilse, Jackson Niedel, Qihua Zhang, Anthony Richardella, Hussein Hijazi, Jeffrey R. Shallenberger, Robert Hengstebeck, Stephanie Law, Nitin Samarth, Frank C. Peiris
In situ forming gelatin/gellan gum hybrid hydrogels containing graphene quantum dots for imaging and effective drug delivery of 5-fluorouracil in local therapy of breast cancer.
Beiragh MF, Shajari G, Tahmasebi M, Amiryagoubi N, Fathi M, Adibkia K
In Situ Quantum Detection of Ferritin Using Spin Defects in Hexagonal Boron Nitride.
Zhang D, Liu H, Zhang Q, Wang T, Zhou H, Duan Y, Bai J, Zhang Z, Wang J