Results 161 to 170 of about 17,630 (246)

A computational study of 2,3-dihydrospiro[carbazole-1,2'-[1,3]dithiolan]- 4(9H)-one compound: Structure, FT-IR, NMR, NLO, and NBO analyses

, 2020
Goncagül Serdaroğlu, Nesimi Uludağ
openalex   +2 more sources

Insight into non-covalent interactions in a tetrachlorocadmate salt with promising NLO properties: Experimental and computational analysis

, 2021
Ikram Jomaa, Noureddine Issaoui, Thierry Roisnel, Houda Marouani   +3 more
openalex   +2 more sources

Crystal structure, Hirshfeld surfaces and DFT computation of NLO active (2E)-2-(ethoxycarbonyl)-3-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino] prop-2-enoic acid

, 2015
Perumal Venkatesan, Subbiah Thamotharan, Andivelu Ilangovan, Hongze Liang, Tom Sundius   +4 more
openalex   +2 more sources

Exploration of linear and third-order nonlinear optical properties for donor-π-linker-acceptor chromophores derived from ATT-2 based non-fullerene molecule. [PDF]

RSC Adv, 2023
Sagir M, Mushtaq K, Khalid M, Khan M, Tahir MB, Braga AAC.   +5 more
europepmc   +1 more source

Theoretical Perspective toward Designing of 5-Methylbenzo [1,2-b:3,4-b':6,5-b″] trithiophene-Based Nonlinear Optical Compounds with Extended Acceptors. [PDF]

ACS Omega, 2023
Shafiq I, Mustafa A, Zahid R, Baby R, Ahmed S, Asghar MA, Ahamad T, Alam M, Braga AAC, Ojha SC.   +9 more
europepmc   +1 more source

Precise standard-model predictions for polarised Z-boson pair production and decay at the LHC. [PDF]

Eur Phys J C Part Fields
Carrivale C, Covarelli R, Denner A, Du D, Haitz C, Hoppe M, Javurkova M, Le DN, Linder J, Sa RCL, Mattelaer O, Mondal S, Ortona G, Pelliccioli G, Poncelet R, Potamianos K, Ruiz R, Schönherr M, Siegert F, Xu L, Wu X, Zanderighi G.   +21 more
europepmc   +1 more source

Quantum chemical computations on molecular composition, spectroscopic properties, topology exploration, NLO, ligand protein interactions and pharmacokinetic evaluation of 8-hydroxyquinolium 3-nitrobenzoate

, 2023
A. Herlin Shamina, Vadivelan Ganesan, V. Bena Jothy, Manikandan Anandhan, S. Muthu, Saleem Javed   +5 more
openalex   +1 more source

Solvent-modulated second harmonic generation in <i>N</i>-alkylated thiohydantoin derivatives: synthesis, characterization, and first-principle insights. [PDF]

RSC Adv
Ali MA, Qureshi MZ, Saleem RSZ, Mojzych M, Sharif A, Arshad M.   +5 more
europepmc   +1 more source

Insights into impact of polar protic and aprotic solvents on bioactive features of 3-(Dimethylaminomethyl)-5-nitroindole: A DFT study and molecular dynamics simulations. [PDF]

PLoS One
Koyambo-Konzapa SJ, Vamhindi BSDR, Khudaykulov B, Sidhom PA, Khan S, Abdelbacki AMM, Abdelrahman AHM, Ibrahim MAA.   +7 more
europepmc   +1 more source

The presence and absence effect of the template on optical nonlinearity responses of magnetic moleculary imprinted polymer. [PDF]

Sci Rep
Nadafan M, Hashemi E, Pahlavani N.
europepmc   +1 more source