Abstract: A method of screening a hydrocarbon stream for potential toxicological hazards. The method involves providing a hydrocarbon stream; conducting 2-dimensional gas chromatography (2D-GC) analysis to quantify saturates and aromatic distribution in the hydrocarbon stream; identifying 2-8 ring aromatic distribution and weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis; relating the weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis to a mutagenicity index (MI), in which the MI is determined in accordance with ASTM Standard Method E 1687; and assessing a potential toxicological hazard of the hydrocarbon stream based on the weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis and a MI threshold value. The 2-8 ring aromatic distribution preferably includes 3-6 ring aromatics, more preferably 3.5-5.5 ring aromatics.

Abstract: A method of screening a hydrocarbon stream for potential toxicological hazards. The method involves providing a hydrocarbon stream; conducting 2-dimensional gas chromatography (2D-GC) analysis to quantify saturates and aromatic distribution in the hydrocarbon stream; identifying 2-8 ring aromatic distribution and weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis; relating the weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis to a mutagenicity index (MI), in which the MI is determined in accordance with ASTM Standard Method E 1687; and assessing a potential toxicological hazard of the hydrocarbon stream based on the weight percentage of 2-8 ring aromatic molecules in the hydrocarbon stream from the 2D-GC analysis and a MI threshold value. The 2-8 ring aromatic distribution preferably includes 3-6 ring aromatics, more preferably 3.5-5.5 ring aromatics.

Abstract: Methods for generating molecular formula distributions beyond a predetermined threshold for a petroleum stream are disclosed. An initial molecular formula distribution within a predetermined threshold is obtained for a petroleum stream. A correlation between two or more molecular properties of the initial molecular formula distribution is identified, and the initial molecular formula distribution is extrapolated beyond the predetermined threshold along the correlation. The extrapolated molecular formula is renormalized based on renormalization data obtained from the sample. The renormalized molecular formula distribution can then be blended with the initial molecular formula distribution, reconciled to secondary analytical measurements, and/or used to create a model of composition and/or a molecular composition-based model of a resid upgrading process. Systems for implementing the methods are also disclosed.

Abstract: Method for determining the composition of a material, including obtaining a reference model of composition (MoC) of the material based on a molecular formula distribution of the material, and reconciling, using at least one computer processor, the reference MoC to match at least one target property of the material, is provided. The reference MoC can be expressed as a combination of molecular lumps with associated reference percent. The reconciliation can be carried out using by constrained optimization of information entropy, and the optimization can be performed on a more coarse-grained basis relative to the reference MoC.

Abstract: A method to determine the model-of-composition of a vacuum resid in which the resid is separated into fractions including the DAO fraction which is then separated into chemical classes including saturates, aromatics, sulfides and polars by a combination of soft ionization methods. The results of the ionization analysis are reconciled with other analysis such as bulk analysis, then consolidated to generate the modeol-of composition.

Abstract: A method to determine the model-of-composition of a vacuum resid in which the resid is separated into fractions including the DAO fraction which is then separated into chemical classes including saturates, aromatics, sulfides and polars by a combination of soft ionization methods. The results of the ionization analyses are reconciled with other analyses such as bulk analysis, then consolidated to generate the modeol-of composition.

Abstract: A method for determining the composition of a material including the steps of fitting multivariate analytical data of the material to a combination of multivariate analytical data in a database to determine coefficients of the combination so as to determine a reference model of composition based on the coefficients and the compositions in the database, wherein the database includes multivariate analytical data of database materials whose compositions are known, and reconciling the reference model of composition to match properties of the material.

Abstract: Method for determining the composition of a material, including obtaining a reference model of composition (MoC) of the material based on a molecular formula distribution of the material, and reconciling, using at least one computer processor, the reference MoC to match at least one target property of the material, is provided. The reference MoC can be expressed as a combination of molecular lumps with associated reference percent. The reconciliation can be carried out using by constrained optimization of information entropy, and the optimization can be performed on a more coarse-grained basis relative to the reference MoC.

Abstract: Methods for generating molecular formula distributions beyond a predetermined threshold for a petroleum stream are disclosed. An initial molecular formula distribution within a predetermined threshold is obtained for a petroleum stream. A correlation between two or more molecular properties of the initial molecular formula distribution is identified, and the initial molecular formula distribution is extrapolated beyond the predetermined threshold along the correlation. The extrapolated molecular formula is renormalized based on renormalized based on renormalization data obtained from the sample. The renormalized molecular formula distribution can then be blended with the initial molecular formula distribution, reconciled to secondary analytical measurements, and/or used to create a model of composition and/or a molecular composition-based model of a resid upgrading process. Systems for implementing the methods are also disclosed.

Abstract: A method to determine the model-of-composition of a vacuum resid wherein the resid is separated into eight fractions, saturates, aromatics, sulfides and polars by a combination of soft ionization methods.

Abstract: The present invention is a method to determine the composition of a hydrocarbon feedstream from a small sample of hydrocarbons including the steps analyzing the sample with a combination of chromatograph and mass spectrometer, and reconciling output from step a) with other analytical measurements to determine to determine the composition of the hydrocarbon feedstream.

Abstract: A method for determining the composition of a material including the steps of fitting multivariate analytical data of the material to a combination of multivariate analytical data in a database to determine coefficients of the combination so as to determine a reference model of composition based on the coefficients and the compositions in the database, wherein the database includes multivariate analytical data of database materials whose compositions are known, and reconciling the reference model of composition to match properties of the material.

Abstract: The present invention provides a process for recovering gas from a clathrate hydrate comprising the steps of: (a) providing a clathrate hydrate within an occupying zone; (b) positioning a source of electromagnetic radiation within said clathrate hydrate occupying zone; and (c) recovering gas from the clathrate hydrate by applying electromagnetic radiation from the electromagnetic radiation source of step (b) to the clathrate hydrate at a frequency within the range of from direct current to visible light at energy density sufficient to dissociate the clathrate hydrate to evolve its constituent gas.

Abstract: A suitable slurry composition allows gas hydrates to be stored or transported under metastable conditions. The slurry includes gas hydrate particles and a carrier liquid for the gas hydrate particles. Suitable carrier liquids have a specific gravity in the range from about 0.6 to about 2, a pour point below about -20.degree. C. a viscosity of about 10 centipoise or less, and a thermal conductivity lower than that of the gas hydrate particles. The slurry can be stored or transported in a system that includes a container for holding the slurry; a device for agitating the slurry while in the container (e.g., a mixing blade, a rotating screw, a reciprocating box beam, or an ultrasound generator); a device for removing excess carrier liquid from the container while it is loaded or being loaded with gas hydrates and/or carrier liquid (e.g., a skimming device or a drain); and a device for reslurrifying the gas hydrates with carrier liquid before or during unloading of the gas hydrates from the container (e.g.

Abstract: A process is disclosed for producing alkyl tertiary alkyl ether such as TAME from alkanol and hydrocarbon feedstock containing linear olefins, iso-olefins, linear alkanes and iso-alkanes such as C5 streams from FCC. The process selectively etherifies iso-olefins in a plural stage etherification zone whose linear olefin-containing effluent is treated by distillation to remove iso-alkanes, and alkanol before passing to a skeletal isomerization zone using constrained intermediate pore size zeolite catalyst such as ZSM-22, ZSM-23, or ZSM-35, which converts linear olefins to iso-olefins which are cycled for etherification. The use of distillation to remove iso-alkanes and alkanol reduces mass flow to the etherification process and minimizes skeletal isomerization catalyst poisoning by alkanol, without resort to water extraction processes which require subsequent treatment of the isomerization zone feed to remove water.

Abstract: A method for conversion of linear C5 olefins in the presence of contaminant diolefins to corresponding iso-olefins of the same carbon number which comprises contacting a linear C5 olefin-containing organic feedstock with a catalyst comprising material having the structure of ZSM-35 under skeletal isomerization conditions, wherein said conversion is carried out at temperatures between about 100.degree. and 750.degree. C., weight hourly space velocities (WHSV) based on linear C5 olefins in said feedstock between 0.1 and 500 WHSV, C5 linear olefin partial pressures between 2 and 2000 kPa, and in the presence of hydrogen added in an amount sufficient to enhance linear C5 olefin conversion activity and extend the catalyst life of the catalyst relative to operation without any hydrogen added.