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 3097-3108 of 9,538

Spectral properties of thymine and its interaction with tryptophan and bioinspired membranes.

Garcia AAM, Okayama NSM, de Souza ES, Marquezin CA

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

Spectral Quantum Chemistry and Infrared Resonance Library for Data-Driven Molecular Spectroscopy.

Krishnadas A, Kansal J, Charron NE, Ragyanszki A

2026 PubMed Scientific data

Spectro-kinetic modelling of photocatalytic oxidation of heterocyclic compounds in a continuous-flow packed bed reactor.

Pal R, Farnood R

2026 PubMed RSC advances

Spectroscopic analysis, quantum chemical calculations and molecular docking studies of the new tridentate Schiff base copper complex functionalized with imidazole

Sümeyye Kırkıncı Yılmaz, Enis Güzel, Ayşen Alaman Ağar, Metin Yavuz

2026 Crossref Journal of Molecular Structure

Spectroscopic and lifetime measurements of C2 in the 33Πg and 43Πg states.

Li D, Wang Z, Ma L, Cheng M, Gao H

2026 PubMed The Journal of chemical physics

Spectroscopic and quantum chemical characterization of 4-[2-(2-Amino-4,7-dihydro-4-oxo-3 H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid with molecular docking and cytotoxicity insights for targeting NSCLC.

Vijayaraghavan M, Petchimuthu R, Rajendran P, Jeganathan M, Amirtham MFB

2026 PubMed In silico pharmacology

Spectroscopic and Theoretical Analysis of N-Ethylphenothiazine Derivatives: Alkyl Chain Length Effects on Solvatochromism, Fluorescence Efficiency, and Excited-State Polarity.

Slodek A, Zych D, Zimosz S, Szafraniec-Gorol G, Kotowicz S, Kubis M, Kowalska-Szojda K, Malarz K, Musioł R

2026 PubMed The journal of physical chemistry. B

Spectroscopic and thermal behavior of ca₈ MgLa(PO₄)₇:Eu(2+),Mn(2+) phosphor powders and polymer composites.

Stefanski M, Vu THQ, Tomala R, Stefańska D

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

Spectroscopic characterization of a Be(2)-benzene complex featuring BeBe quasi-triple bond.

Wang C, Guan XL, Nie YY, Gao MX, Qiu W, Xu J, You T, Wu YB, Jian J

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

Spectroscopic characterization of NH(A(3)Π): Linewidths and energy level shifts.

da Silva RS, Alves MDS, Souza SR, Fellows CE

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

Spectroscopic performance enhancement in GAGG:Ce scintillator via CsPbBr3 quantum dot and PMMA surface coatings

Jae Hyung Park, Seunghyeon Kim, Sangjun Lee, Jinhong Kim, Cheol Ho Pyeon, Seunghyun Cho, Bongsoo Lee

2026 Crossref Radiation Measurements

Spectroscopic Studies of 1,2-Dibromobenzene Using Synchrotron Radiation in the UV-VUV Region.

Gorai KK, Das AK, Shastri A

2026 PubMed The journal of physical chemistry. A