Browsing Institutt for kjemi by Title
Now showing items 354-373 of 1353
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Entropy production beyond the thermodynamic limit from single-molecule stretching simulations
(Peer reviewed; Journal article, 2020)Single-molecular systems are a test bed to analyze to what extent thermodynamics applies when the size of the system is drastically reduced. Isometric and isotensional single-molecule stretching experiments and their ... -
Entropy Production Minimization as Design Principle for Membrane Systems: Comparing Equipartition Results to Numerical Optima
(Journal article; Peer reviewed, 2017)Entropy production minimization procedures presented in literature show that under different assumptions the optimal solution might be characterized by different thermodynamic quantities being constant. These constant ... -
Environmental cycling of atmospheric mercury in the Arctic: Chemical fractionation, desposition and post despositional fate
(Doktoravhandlinger ved NTNU, 1503-8181; 2011:272, Doctoral thesis, 2011) -
Epothilones as Anticancer Drugs
(Bachelor thesis, 2020) -
Equation of state for confined fluids
(Peer reviewed; Journal article, 2022)Fluids confined in small volumes behave differently than fluids in bulk systems. For bulk systems, a compact summary of the system's thermodynamic properties is provided by equations of state. However, there is currently ... -
Equation-of-motion coupled-cluster method with double electron-attaching operators: Theory, implementation, and benchmarks
(Journal article, 2021)We report a production-level implementation of the equation-of-motion (EOM) coupled-cluster (CC) method with double electron-attaching (DEA) EOM operators of 2p and 3p1h types, EOM-DEA-CCSD. This ansatz, suitable for ... -
Equilibrium and Nonequilibrium Thermodynamics of Planar and Curved Interfaces
(Doctoral thesis at NTNU;2015:301, Doctoral thesis, 2015)Interfaces can be found everywhere and their properties are of major importance to a wide variety of processes, ranging from DNA replication to weather forecasts. This work is a fundamental study of systems with planar ... -
Equilibrium geometry optimization using a multilevel Hartree-Fock wave function
(Master thesis, 2020)Optimering av likevektsgeometrier er et viktig trinn i studiet av diverse molekylære egenskaper. Mangle slike egenskaper er lokale, hovedsaklig knyttet til en liten region av det totale molekylære systemet. Dette gjør ... -
Equilibrium properties of the reaction H2=2H by classical molecular dynamics simulations
(Journal article; Peer reviewed, 2014)We have developed a classical molecular dynamics model for the hydrogen dissociation reaction, containing two- and three-particle potentials derived by Kohen, Tully and Stillinger. Two fluid densities were investigated for ... -
Er fullstendig selektiv inhibering av CLK1 en mulighet?
(Bachelor thesis, 2021)Cdc2-like kinase 1 (CLK1) er en proteinkinase som er involvert i pre-mRNA spleising. Den er sammenkoblet med flere sykdommer. Derfor er inhibering av CLK1 er et svært aktuelt tema, da dette kan forhindre flere lidelser. ... -
Er GAC og PAC effektive metoder for å fjerne PFAS fra vann?
(Bachelor thesis, 2020)Det er funnet sannsynlige sammenhenger mellom helserelaterte plager hos mennesker og per- og polyfluoroalkyl-forbindelser (PFAS). Disse forbindelsene har vært brukt i stor skala over lang tid, og finnes i dag over hele ... -
Er kvikksølv i snø i Arktis av atmosfærisk eller marin opprinnelse?: En studie av metylkvikksølv, totalkvikksølv og marine hovedioner i arktisk snø
(Master thesis, 2010)Organismer på toppen av Arktiske marine næringskjeder inneholder ofte forhøye dekonsentrasjoner av monometylkvikksølv (MMHg) (AMAP, 2002). MMHg er en giftig form av kvikksølv (Hg) som kan bioakkumuleres (Jæger m.fl., 2007; ... -
Er peptidvaksiner fremtiden for behandling av Alzheimers sykdom?
(Bachelor thesis, 2020) -
Erstatning av bisfenol A med bisfenol S i bruk som matkontaktmaterial
(Bachelor thesis, 2020) -
Escape from the Flatland: Synthesis of Tetrahydropyran Substituted Pyrrolopyrimidines as CSF-1R Inhibitors
(Master thesis, 2021)Overekspresjon av den kolonistimulerende faktor 1-reseptoren, CSF-1R har blitt implisert i mange sykdomsforløp som for eksempel kreftdannelse og beinlidelser. CSF-1R kinasen har derfor vært et viktig mål for behandling av ... -
Establishing Predictive Models for Solvatochromic Parameters of Ionic Liquids
(Journal article; Peer reviewed, 2019)The use of ionic liquids (ILs) in applications ranging from catalysis to reaction media in organic synthesis has been successfully demonstrated in several cases. For any given IL application, fundamental properties, such ... -
Ethiopian Christian Paintings from a Physico-chemical Perspective: The Wall Paintings of Yemrehanna Krestos, Petros Paulos and Abune Yemata Guh Churches
(Doctoral theses at NTNU;2016:119, Doctoral thesis, 2016)Summary of thesis: During the past decades there has been an increasing application of scientific analytical methods in the area of conservation of cultural heritage objects and to address art historical and archaeometric ... -
Ethyl acetate in ethanol fermented beverages: elucidation of pathways and parameters affecting production
(Bachelor thesis, 2022)Bacheloroppgaven omhandler et forsøkt på å kartlegge reaksjonsveier til etylacetat i etanolfermenterte næringsmidler. Resultatene fra gjennomgåtte studier antyder at etylacetat blir dannet under fermentering ved biosyntetiserte ... -
Evaluating characterization methods for new porous functional materials
(Doctoral theses at NTNU;2021:312, Doctoral thesis, 2021)This thesis is concerned with the development and evaluation of characterization methods for new porous functional materials. Functionalized one-dimensional silicoaluminophosphates (SAPOs) were chosen as model systems for ...