Search Results - "Urbič, Tomaž"

Analytical Modeling of Thermodynamic and Transport Anomalies of Water by Urbic, Tomaz

“…The structures and properties of biomolecules like proteins, nucleic acids, and membranes depend on water. Water is also very important in industry. Overall,…”
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Counterion-Induced Aggregation of Metallacarboranes by Medoš, Žiga, Hleli, Belhssen, Tošner, Zdeněk, Ogrin, Peter, Urbič, Tomaž, Kogej, Ksenija, Bešter-Rogač, Marija, Matějíček, Pavel

“…The model of counterion-induced metallacarborane aggregation in water was verified on sodium bis­(1,2-dicarbollide), one of the most studied examples of…”
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Hydrogen bonding between hydrides of the upper-right part of the periodic table by Simončič, Matjaž, Urbic, Tomaz

“…One of the most important electrostatic interactions between molecules is most definitely the hydrogen bond. Understanding the basis of this interaction may…”
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Closo-dodecaborate-based dianionic surfactants with distorted classical morphology: Synthesis and atypical micellization in water by Hleli, Belhssen, Medoš, Žiga, Ogrin, Peter, Tošner, Zdeněk, Kereïche, Sami, Gradzielski, Michael, Urbič, Tomaž, Bešter-Rogač, Marija, Matějíček, Pavel

“…[Display omitted] To challenge the classical concept of step-like micellization of ionic surfactants with singular critical micelle concentration, novel…”
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Thermodynamics of the ion association of potassium cobalt(III) bis(1,2-dicarbollide) in acetonitrile, methanol and dimethyl sulfoxide by Šarac, Bojan, Ogrin, Peter, Medoš, Žiga, Urbič, Tomaž, Matějíček, Pavel, Bešter-Rogač, Marija

“…[Display omitted] •Conductivities of K[COSAN] in acetonitrile, methanol, and dimethyl sulfoxide were determined accurately at various…”
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Water–Aluminum Interaction as Driving Force of Linde Type A Aluminophosphate Hydration by Hubman, Anže, Volavšek, Janez, Urbič, Tomaž, Zabukovec Logar, Nataša, Merzel, Franci

“…Linde type A (LTA) aluminophosphate is a promising candidate for an energy storage material used for low-temperature solar and waste-heat management. The…”
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Properties of Methanol-Water Mixtures in a Coarse-Grained Model by Huč, Matej, Žakelj, Gašper, Urbič, Tomaž

“…Methanol and water rank among the most important liquids in modern world due to their versatile use. As water, methanol and their mixtures exhibit numerous…”
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Process Intensification and Miniaturization of Chemical and Biochemical Processes by Strniša, Filip, Urbič, Tomaž, Žnidaršič-Plazl, Polona, Plazl, Igor

“…In this work, the microscale (bio)process development based on scale-up/numbering-up concept in combination with model-based optimization is presented. The…”
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Amino Acid Correlation Functions in Protein Structures by Kržišnik, Klemen, Urbic, Tomaz

“…Understanding the spatial folding of proteins from their amino acid sequences has an enormous potential in contemporary life sciences. The ability to predict…”
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Quantum chemical tests of water-water potential for interaction site water models by Huš, Matej, Urbič, Tomaž

“…Accuracy of different simple interaction site water models was tested. Instead of assessing their quality through the calculations of various water physical…”
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A microscopic theory of solvation of monoions by Urbič, Tomaž, Fennell, Christopher J, Dill, Ken A

“…The solvation free energies of ions are often computed using continuum theories, like the Born model. The Born model has the disadvantages that to fit…”
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Thermodynamic properties of water in confined environments: a Monte Carlo study by Gladovic, Martin, Bren, Urban, Urbic, Tomaž

“…Monte Carlo simulations of Mercedes-Benz water in a crowded environment were performed. The simulated systems are representative of both composite, porous or…”
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The Magnetic Field Freezes the Mercedes-Benz Water Model by Urbic, Tomaz

“…In this study, we investigate the impact of magnetic fields on the structural and thermodynamic properties of water. To accomplish this, we employed the…”
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Two-dimensional core-softened model with water like properties: Monte Carlo and integral equation study by Urbic, Tomaz

“…Monte Carlo simulations and integral equation theory were used to study the thermodynamics and structure of particles interacting through the smooth version of…”
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Strength of hydrogen bonds of water depends on local environment by Huš, Matej, Urbic, Tomaz

“…In-depth knowledge of water-water potential is important for devising and evaluating simple water models if they are to accurately describe water properties…”
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Properties of the Lennard-Jones dimeric fluid in two dimensions: an integral equation study by Urbic, Tomaz, Dias, Cristiano L

“…The thermodynamic and structural properties of the planar soft-sites dumbbell fluid are examined by Monte Carlo simulations and integral equation theory. The…”
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Properties of a soft-core model of methanol: an integral equation theory and computer simulation study by Huš, Matej, Munaò, Gianmarco, Urbic, Tomaz

“…Thermodynamic and structural properties of a coarse-grained model of methanol are examined by Monte Carlo simulations and reference interaction site model…”
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The hydrophobic effect in a simple isotropic water-like model: Monte Carlo study by Huš, Matej, Urbic, Tomaz

“…Using Monte Carlo computer simulations, we show that a simple isotropic water-like model with two characteristic lengths can reproduce the hydrophobic effect…”
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A structural study of a two-dimensional electrolyte by Monte Carlo simulations by Aupic, Jana, Urbic, Tomaz

“…Properties of superconducting and superfluid thin films, modeled as a two-dimensional classic Coulomb fluid, are connected to the molecular structure of the…”
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Molecular Simulations Find Stable Structures in Fragments of Protein G by Urbič, Tjaša, Urbič, Tomaž, Avbelj, Franc, Dill, Ken A

“…We perform all-atom computer simulations on nearly one hundred 6-, 8-, 10-, and 12-mer peptide fragments of protein G, and look for stable states. We simulated…”
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