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A Globally-Convergent Flash Calculation for Constant K-Values Based on a Parameterization of the Tie-Line Field

机译:基于Tie-Line字段的参数化的常数K值的全局收敛闪光计算

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We propose a novel approach to ash calculation, with particular application to negative ash. The ability to compute a negative ash for any composition state is important in practice, as the construction of analytical solutions for multicomponent systems by the method of characteristics (MOC) relies heavily on the identi cation of tie lines and tie-line extensions. MOC solutions are at the heart of some techniques for the calculation of the minimum miscibility pressure, and are the key building blocks for fast simulation of multidimensional reservoir ows by the front-tracking / streamline method. The basis of the proposed negative-ash method is a parameterization of the tie-line eld. Rather than solving the Rachford-^sRice equation (or any of its variants) we solve directly for the parameters defning the tie line. For an N-component system, our approach leads to a system of N - 2 quadratic equations, which we solve effciently using a Newton method. The iterative method is very robust: unlike other negative ash procedures, the solution displays continuous dependence on the overall composition, even in the transition to negative concentrations. We illustrate the properties and behavior of the proposed approach on three-component and four-component systems, and we then generalize the method to systems of N components. From the global triangular structure of the system with constant K-values, it follows that the system of N -2 quadratic equations can only have two roots. For the important case of three components, the ash calculation is explicit.
机译:我们提出一种新的灰分计算方法,特别适用于负灰分。在实践中,为任何组成状态计算负灰的能力是重要的,因为通过特性方法(MOC)的多组分系统的分析解决方案的构建依赖于系带线和系带延伸的识别率。 MOC解决方案在一些技术的核心中,用于计算最小混溶性压力,是通过前跟踪/流线方法快速模拟多维储存器的关键构建块。所提出的负灰法的基础是铁路线ELD的参数化。而不是解决Rachford-^ SRICE方程(或其任何变体),我们直接解决了界定系数的参数。对于N组件系统,我们的方法导致了N - 2二次方程的系统,我们使用牛顿方法效生效。迭代方法非常坚固:与其他负灰分脉不同,溶液表现出对整个组成的连续依赖性,即使在过渡到负浓度也是如此。我们说明了三个组件和四组件系统上所提出的方法的属性和行为,然后我们将方法概括为N个组件的系统。从系统的全局三角形结构具有恒定的k值,所以遵循N-2二次方程的系统只能有两个根。对于三个组件的重要情况,灰分计算是明确的。

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