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Mon, 15 May 2023

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Preprint REVIEW | doi:10.20944/preprints202305.0970.v1

Effect of Nanoparticle Interaction on Structural, Conducting and Sensing Properties of Mixed Metal Oxides

Leonid I Trakhtenberg, Maria I Ikim, Olusegun J Ilegbusi, Vladimir F Gromov, Genrikh N Gerasimov

Subject: Physical Sciences, Chemical Physics Keywords: mixed metal oxide sensors; nanoparticles interaction; morphology; structure; sensing properties

Online: 15 May 2023 (03:34:15 CEST)

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Mon, 24 April 2023

Preprint ARTICLE | doi:10.20944/preprints202304.0854.v1

TAO-DFT with the Polarizable Continuum Model

Sonai Seenithurai, Jeng-Da Chai

Subject: Physical Sciences, Chemical Physics Keywords: TAO-DFT; Polarizable Continuum Model; multi-reference character

Online: 24 April 2023 (10:59:26 CEST)

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Mon, 3 April 2023

Preprint ARTICLE | doi:10.20944/preprints202304.0012.v1

Molecular Dynamics Simulations Suggest Sars-Cov-2 3clpro Mutations in Beta and Omicron Variants do not Alter Binding Affinities for Cleavage Sites of Non-Structural Proteins

Vitor Martins De Freitas Amorim, Robson Francisco de Souza, Cristiane R. Guzzo, Anacleto Silva de Souza

Subject: Physical Sciences, Chemical Physics Keywords: Molecular Dynamics; SARS-CoV-2 variants of concern; 3CLpro; viral load

Online: 3 April 2023 (07:25:07 CEST)

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Wed, 19 October 2022

Preprint ARTICLE | doi:10.20944/preprints202210.0272.v1

Separation of Molar Weight-Distributed Polyethylene Glycols by Reversed-Phase Chromatography – Analysis and Modelling Based on Isocratic Analytical-Scale Investigations

Malvina Supper, Kathleen Heller, Jakob Söllner, Tuomo Sainio, Malte Kaspereit

Subject: Physical Sciences, Chemical Physics Keywords: polyethylene glycol; monodisperse PEG; reversed-phase chromatography; thermodynamic analysis; modelling

Online: 19 October 2022 (07:39:14 CEST)

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Wed, 12 January 2022

Preprint ARTICLE | doi:10.20944/preprints202201.0179.v1

The Effect of Electric Energy Accumulation by Hydrated ZrO2 – Nanoparticles

Alexander S. Doroshkevich, Artem V. Shylo, Andriy I. Lyubchyk, Boris L. Oksengendler, Tatyana Yu. Zelenyak, Nurbol O. Appazov, Andriy K. Kirillov, Tatyana A. Vasilenko, Alisa A. Tatarinova, Oksana O. Gorban, Viktor I. Bodnarchuk, Nadejda N. Nikiforova, Maria Balasoiu, Diana M. Mardare, Carmen Mita, Dorin Luca, Matlab N. Mirzayev, Asif A. Nabiyev, Evgeni P. Popov, Anca I. Stanculescu, Tatyana E. Konstantinova, Yulia V. Aleksiayenak

Subject: Physical Sciences, Chemical Physics Keywords: Zirconium oxide; powder nanotechnologies; nanoionic capacitors; nanoelectronics; dimensional effects

Online: 12 January 2022 (17:46:13 CET)

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Tue, 19 October 2021

Preprint ARTICLE | doi:10.20944/preprints202110.0269.v1

The Structural, Elastic, Electronic, Vibrational and Gravimetric Hydrogen Capacity Properties of the Perovskite Type Hydrides: DFT Study

Ülkü Bayhan, İnanç Yilmaz

Subject: Physical Sciences, Chemical Physics Keywords: Hydrogen; DFT; Electronic Properties; Energy Storage; Perovskite type Hydrides

Online: 19 October 2021 (10:37:03 CEST)

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Tue, 28 September 2021

Preprint ARTICLE | doi:10.20944/preprints202109.0469.v1

Convection – Diffusion – Radiation Heat and Mass Transfer to a Sphere Accompanied by a Surface Exothermal Chemical Reaction

Gheorghe Juncu

Subject: Physical Sciences, Chemical Physics Keywords: heat transfer; mass transfer; convection-radiation; surface reaction; diffusion approximation; finite difference.

Online: 28 September 2021 (11:38:54 CEST)

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Mon, 30 August 2021

Preprint ARTICLE | doi:10.20944/preprints202108.0546.v1

Theoretical Investigation of Glycine Micro-solvated. Energy and NMR Spin Spin Coupling Constants Calculations

Maria Cristina Caputo, Patricio Federico Provasi

Subject: Physical Sciences, Chemical Physics Keywords: Glycine; Microsolvation; Energy; NMR; SSCC

Online: 30 August 2021 (14:05:35 CEST)

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Mon, 7 June 2021

Preprint ARTICLE | doi:10.20944/preprints202106.0178.v1

Application of the Generalized Nonlinear Constitutive Law in 2D Shear Flexible Beam Structures

Damian Mrówczyński, Tomasz Gajewski, Tomasz Garbowski

Subject: Physical Sciences, Chemical Physics Keywords: generalized nonlinear constitutive law; composite beam; Timoshenko beam; Bernoulli beam

Online: 7 June 2021 (12:48:26 CEST)

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Fri, 18 September 2020

Preprint ARTICLE | doi:10.20944/preprints202009.0437.v1

Wetting and Evaporation of Solvents on Thin Soluble Substrates

Christian Wolf, Tatiana Gambaryan-Roisman

Subject: Physical Sciences, Chemical Physics Keywords: wetting of soluble substrates; spreading; evaporation; polymer coating; surface topography

Online: 18 September 2020 (12:07:46 CEST)

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Wed, 5 February 2020

Preprint ARTICLE | doi:10.20944/preprints202002.0053.v1

Laser-Plasma Spectroscopy of Hydroxyl with Applications

Christian G. Parigger, Christopher M. Helstern, Benjamin S. Jordan, David M. Surmick, Robert Splinter

Subject: Physical Sciences, Chemical Physics Keywords: plasma diagnostics; molecular spectra; diatomic molecules; plasma spectroscopy; laser spectroscopy; laser-induced breakdown spectroscopy; optical emission spectroscopy; molecular excitation temperature; combustion analysis; astrophysical spectroscopy

Online: 5 February 2020 (03:27:47 CET)

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Thu, 19 December 2019

Preprint ARTICLE | doi:10.20944/preprints201912.0259.v1

Investigation of Propane and n- butane Hydrate Formation Condition and Determination of Equilibrium Pressure

Somayeh Salehfekr, Sajjad Porgar, Nejat Rahmanian

Subject: Physical Sciences, Chemical Physics Keywords: hydrate; propane; normal butane; equilibrium pressure

Online: 19 December 2019 (13:10:12 CET)

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Thu, 28 March 2019

Preprint ARTICLE | doi:10.20944/preprints201903.0254.v1

Plasma Metabolites Associated with Brain MRI Measures in Older Adults in the Atherosclerosis Risk in Communities – Neurocognitive Study (ARIC-NCS)

Danni Li, Jeffrey R. Misialek, Clifford R. Jack, Michelle M. Mielke, David Knopman, Rebecca Gottesman, Thomas Mosley, Alvaro Alonso

Subject: Physical Sciences, Chemical Physics Keywords: metabolomics; sphingomyelins; plasma; cerebral small vessel disease; neurodegeneration; brain atropy

Online: 28 March 2019 (05:27:23 CET)

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Fri, 8 March 2019

Preprint ARTICLE | doi:10.20944/preprints201903.0106.v1

An Experimental Study for the Remediation of Industrial Waste Water Using Combination of Low Cost Mineral Raw Materials

Petros Petrounias, Aikaterini Rogkala, Panagiota P. Giannakopoulou, Basilios Tsikouras, Paraskevi Lampropoulou, Stavros Kalaitzidis, Konstantin Hatzipanagiotou, Nicolaos Lambrakis, Marina A. Christopoulou

Subject: Physical Sciences, Chemical Physics Keywords: sterile aggregates; remediation of waste water; peat; biochar

Online: 8 March 2019 (08:57:21 CET)

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Fri, 30 November 2018

Preprint REVIEW | doi:10.20944/preprints201811.0625.v1

Encapsulation of Organic and Perovskite Solar Cells: A Comprehensive Review

Ashraf Uddin, Mushfika Baishakhi Upama, Haimang Yi, Leiping Duan

Subject: Physical Sciences, Chemical Physics Keywords: organic solar cells; perovskite solar cells; encapsulation; stability

Online: 30 November 2018 (09:38:24 CET)

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Thu, 29 November 2018

Preprint REVIEW | doi:10.3390/sci1010005.v1

Isomerization and Properties of Isomers of Carbocyanine Dyes

Pavel Pronkin, Alexander Tatikolov

Subject: Physical Sciences, Chemical Physics Keywords: carbocyanine dyes; isomerization; trans and cis isomers; <em>meso</em>-substituted cyanines

Online: 29 November 2018 (00:00:00 CET)

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Tue, 16 October 2018

Preprint COMMUNICATION | doi:10.20944/preprints201810.0339.v1

Better Resolution of High-Spin Cobalt Hyperfine at Low Frequency: Co-Doped Ba(Zn_1/3Ta_2/3)O₃ as a Model Complex

William E. Antholine, Shengke Zhang, Justin Gonzales, Nathan Newman

Subject: Physical Sciences, Chemical Physics Keywords: electron paramagnetic resonance; EPR; multi-frequency EPR; high-spin cobalt complex; resolution of A-mid

Online: 16 October 2018 (08:04:16 CEST)

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Fri, 16 March 2018

Preprint REVIEW | doi:10.20944/preprints201803.0134.v1

Modelling and Development of Electrical Aptasensors, a Short Review

Rosella Cataldo, Maria Leuzzi, Eleonora Alfinito

Subject: Physical Sciences, Chemical Physics Keywords: aptamer; aptasensor; electrical properties; networks; proteotronics

Online: 16 March 2018 (11:12:17 CET)

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Tue, 23 January 2018

Preprint ARTICLE | doi:10.20944/preprints201801.0211.v1

Membranes: A Variety of Energy Landscapes for Many Transfer Opportunities

Patrice Bacchin

Subject: Physical Sciences, Chemical Physics Keywords: membrane transport; osmosis; interaction

Online: 23 January 2018 (06:43:31 CET)

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Mon, 18 July 2016

Preprint ARTICLE | doi:10.20944/preprints201607.0048.v1

Fractal features of Fermi Blazar Light Curves

Yi Liu, Wei Cai, Junhui Fan

Subject: Physical Sciences, Chemical Physics Keywords: galaxies:blazar; light curve; simulation

Online: 18 July 2016 (10:36:38 CEST)

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