Extrapolation methods for improving the convergence of oligomer calculations to the infinite chain limit of quasi-one-dimensional stereoregular polymers.
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Publication:1416381
DOI10.1016/S0898-1221(03)80014-7zbMath1161.82374arXivmath/0004115OpenAlexW2000693310MaRDI QIDQ1416381
B. Kirtman, Ernst Joachim Weniger
Publication date: 14 December 2003
Published in: Computers \& Mathematics with Applications (Search for Journal in Brave)
Full work available at URL: https://arxiv.org/abs/math/0004115
polymersExtrapolation methodsQuantum chemical oligomer calculationsQuasi-one-dimensional stereoregularSequence transformations
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