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The Journal of Chemical Physics, ISSN 0021-9606, 12/2016, Volume 145, Issue 21, p. 211705
Journal Article
Chemical Reviews, ISSN 0009-2665, 06/2016, Volume 116, Issue 12, pp. 7078 - 7116
The nucleation of crystals in liquids is one of nature’s most ubiquitous phenomena, playing an important role in areas such as climate change and the... 
METHANE HYDRATE NUCLEATION | PHASE-CHANGE MATERIALS | FREESTANDING THIN-FILMS | METASTABLE ZONE WIDTH | NO-MANS-LAND | HARD-SPHERE COLLOIDS | DIFFERENTIAL SCANNING CALORIMETRY | HOMOGENEOUS ICE NUCLEATION | LENNARD-JONES SYSTEM | DENSITY-FUNCTIONAL THEORY | CHEMISTRY, MULTIDISCIPLINARY | Physics - Materials Science | Review
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 04/2015, Volume 17, Issue 14, pp. 8870 - 8876
The results of six high-precision constant energy molecular dynamics (MD) simulations initiated from methane-water systems equilibrated at 80 MPa and 250 K... 
DYNAMICS SIMULATIONS | CRYSTAL-NUCLEATION | GAS HYDRATE | COEXISTENCE | PRESSURE | ENERGY | HOMOGENEOUS NUCLEATION | INTERFACE | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | MODEL | METASTABILITY | Nucleation | Pathways | Simulation | Formations | Trajectories | Boundaries | Methane hydrates | Hydrates
Journal Article
Cement and Concrete Research, ISSN 0008-8846, 11/2018, Volume 113, pp. 74 - 85
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 04/2015, Volume 17, Issue 14, pp. 8870 - 8876
The results of six high-precision constant energy molecular dynamics (MD) simulations initiated from methane-water systems equilibrated at 80 MPa and 250 K... 
Journal Article
Science, ISSN 0036-8075, 11/2009, Volume 326, Issue 5956, pp. 1095 - 1098
Despite the industrial implications and worldwide abundance of gas hydrates, the formation mechanism of these compounds remains poorly understood. We report... 
Methane | Potential energy | Molecules | Thermodynamics | Liquids | Nucleation | Crystals | Reports | Trajectories | Hydrates | Crystal structure | CRYSTALLIZATION | PRESSURE | INTERFACE | CRYSTAL-GROWTH | MULTIDISCIPLINARY SCIENCES | GAS | CLATHRATE HYDRATE | HYDROGEN CLUSTERS | MOLECULAR-DYNAMICS SIMULATION | CARBON-DIOXIDE | WATER | Methane hydrate | Models | Chemical properties | Growth | Gases | Chemistry | Simulation | Adsorption
Journal Article
Atmospheric Chemistry and Physics, ISSN 1680-7316, 2010, Volume 10, Issue 10, pp. 4961 - 4974
We have studied the hydration of sulfuric acid - ammonia and sulfuric acid - dimethylamine clusters using quantum chemistry. We calculated the formation... 
H2SO4 | SECONDARY ORGANIC AEROSOL | ENVIRONMENTAL SCIENCES | TERNARY NUCLEATION | AMMONIUM BISULFATE | HYDRATE FORMATION | DENSITY-FUNCTIONAL THEORY | GROWTH-RATES | IMPROVED MODEL | METEOROLOGY & ATMOSPHERIC SCIENCES | PARTICLE FORMATION EVENTS | ATMOSPHERE
Journal Article
Chemical Engineering Science, ISSN 0009-2509, 11/2016, Volume 155, pp. 1 - 9
The second generation High Pressure Automated Lag Time Apparatus (HP–ALTA MkII) was used to measure the nucleation curves of Structure II (sII)–forming... 
Probability | Gas hydrate | Nucleation rate | Subcooling | Kinetics | Nucleation curve | CRYSTALLIZATION | ENGINEERING, CHEMICAL | PROBABILITY-DISTRIBUTIONS | SYSTEMS | WATER | SOLUBILITY | Methane | Gas hydrates | Analysis | Propane | Hydrates
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 12/2012, Volume 134, Issue 48, pp. 19544 - 19547
Methane hydrates are ice-like inclusion compounds with importance to the oil and natural gas industry, global climate change, and gas transportation and... 
CRYSTALLIZATION | GAS HYDRATE | HYBRID MONTE-CARLO | ENERGY | MECHANISM | GROWTH | LIQUID WATER | CLATHRATE HYDRATE | PHASE-EQUILIBRIA | MOLECULAR-DYNAMICS SIMULATIONS | CHEMISTRY, MULTIDISCIPLINARY | Methane | Thermal properties | Usage | Nucleation | Analysis | Molecular dynamics | Chemical properties | Simulation methods
Journal Article
Chemical Engineering Journal, ISSN 1385-8947, 03/2019, Volume 360, pp. 569 - 576
[Display omitted] •Hydrated RHO zeolite promotes methane hydrates formation at mild pressure conditions.•RHO zeolite provides nucleation sites to initiate this... 
RHO | Methane hydrate | Clathrate | Nucleation | Zeolite | Adsorption | CRYSTAL-STRUCTURE | FLEXIBILITY | ZEOLITE RHO | ENGINEERING, CHEMICAL | HYDROGEN | ENGINEERING, ENVIRONMENTAL | FRAMEWORK | CARBON-DIOXIDE | WATER | Methane | Catalysis | Zeolites | Hydrates
Journal Article
Journal of Crystal Growth, ISSN 0022-0248, 2002, Volume 243, Issue 3, pp. 476 - 489
The kinetics of nucleation of one-component gas hydrates in aqueous solutions are analyzed. The size of the hydrate nucleus and the work for nucleus formation... 
A1. Aqueous solutions | A1. Nucleation | B1. Gas hydrates | ETHANE | TESTS | aqueous solutions | MECHANISMS | CRYSTALLOGRAPHY | ADDITIVES | nucleation | INDUCTION TIME | PRECIPITATION | gas hydrates | CRYSTAL-GROWTH | METHANE HYDRATE | KINETIC INHIBITORS | EFFICIENCY
Journal Article
Thermochimica Acta, ISSN 0040-6031, 10/2018, Volume 668, pp. 178 - 184
•Isothermal nucleation of methane hydrate in the presence of decane was studied.•Two-step shape of the empirical survival curves was observed.•Aggregate state... 
Empirical survival curves | Methane hydrate | Decane | Supercooling | Nucleation | CHEMISTRY, ANALYTICAL | STATE NUCLEATION | CHEMISTRY, PHYSICAL | CURVES | PRESSURE | INHIBITION | THERMODYNAMICS | TEMPERATURES | CRYSTAL-GROWTH | CRYSTALLIZATION KINETICS | LIQUID WATER | GAS | INTERFACES | Methane | Analysis
Journal Article
Langmuir, ISSN 0743-7463, 09/2018, Volume 34, Issue 37, pp. 10889 - 10896
Elastic materials are candidates for process intensification of gas storage by forming gas hydrate. In this work, molecular dynamics simulations of hydrate... 
GRAPHITE SURFACES | GAS HYDRATE | SOLID-SURFACES | MATERIALS SCIENCE, MULTIDISCIPLINARY | CLATHRATE | CHEMISTRY, PHYSICAL | CHEMISTRY, MULTIDISCIPLINARY | INTERFACE | GROWTH | LIQUID WATER | MONTMORILLONITE | SILICA | MOLECULAR-DYNAMICS SIMULATIONS
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 12/2016, Volume 145, Issue 21, p. 211909
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 10/2015, Volume 137, Issue 42, pp. 13658 - 13669
What makes a material a good ice nucleating agent? Despite the importance of heterogeneous ice nucleation to a variety of fields, from cloud science to... 
SUPERCOOLED WATER | MOLECULAR-DYNAMICS | HYDRATE NUCLEATION | AEROSOLS | PARTICLES | NO-MANS-LAND | ELECTRIC-FIELDS | MODEL | CHEMISTRY, MULTIDISCIPLINARY | SAMPLING METHOD | PHOTOELECTRON-SPECTROSCOPY | Water | Molecular dynamics | Usage | Nucleation | Hydrophobicity | Chemical properties
Journal Article
Journal of Crystal Growth, ISSN 0022-0248, 03/2018, Volume 485, pp. 54 - 68
•Hydrate formation in systems of gas – water – organic liquid was studied.•At the initial stage hydrate film covered the water – organic liquid... 
B1. Gas hydrate | B1. Crude oil | B1. Ice | B1. Decane | A1. Nucleation | A1. Morphology | CRYSTALLIZATION | PHYSICS, APPLIED | Nucleation | OIL-EMULSIONS | MATERIALS SCIENCE, MULTIDISCIPLINARY | Ice | CRYSTALLOGRAPHY | MODEL | Gas hydrate | Decane | METHANE | DISSOCIATION | SURFACTANT | Crude oil | Morphology | CRYSTAL-GROWTH | KINETICS | INHIBITORS | DRIVING-FORCE
Journal Article