Correlations between experimental and theoretical adiabatic ionization energies for organic compounds and rate constants for atmospheric reactions with hydroxyl radicals [PDF]
, 2010 Adiabatic ionization energy (AIE) calculations were performed at the AM1, PM3, PM6, PDDG, HF/QZVP, and B3LYP/QZVP levels of theory on 722 atmospherically relevant organic compounds with available experimental rate constants for atmospheric reactions with
Kaya Forest, Sierra Rayne
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Post occupancy evaluation for functional aspects with emphasis on emergency evacuation
ARTEKS : Jurnal Teknik Arsitektur, 2016 Evaluasi paska guna merupakan salah satu alat untuk mengukur kualitas sebuah bangunan ketika bangunan tersebut telah digunakan. Evaluasi ini digunakan untuk meningkatkan kualitas sebuah bangunan dari segi yang tidak dapat dilihat ketika proses ...
Forest Jieprang
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Performance of the ALOGPS 2.1 program for octanol-water partition coefficient prediction with organic chemicals on the Canadian Domestic Substances List [PDF]
, 2010 The KOWWIN and ALOGPS octanol-water partition coefficient (K~ow~) estimation software programs were compared for their capacity to accurately predict log K~ow~ values of 1545 organic compounds on the publicly available Domestic Substances List (DSL) from
Kaya Forest, Sierra Rayne
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VertigO, 2016 Some fifty years ago the question of durability made its spectacular start in urban discourse. It is currently the inescapable reference in urban policies. However designing a sustainable city has given rise to fierce controversies. In this paper we will
Joëlle Forest
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Gas phase hydration, bond dissociation enthalpies, and acidity of aldehydes: A CBS-Q//B3, G4MP2, and G4 theoretical study of substituent effects [PDF]
, 2010 CBS-Q//B3, G4MP2, and G4 composite method calculations were used to estimate gas phase standard state (298.15 K, 1 atm) free energies of hydration (Δ~hydr~G°~(g)~), hydration equilibrium constants (log K~hydr,(g)~), bond dissociation ...
Kaya Forest, Sierra Rayne
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Questioning size effects as predicted by strain gradient plasticity
Journal of the Mechanical Behavior of Materials, 2013 The analytical solution of the elastic-plastic response of a two-phase laminate microstructure subjected to periodic simple shear loading conditions is derived considering strain gradient and micromorphic plasticity models successively. One phase remains
Forest Samuel
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The random forest algorithm for statistical learning
The Stata Journal, 2020 Random forests (Breiman, 2001, Machine Learning 45: 5–32) is a statistical- or machine-learning algorithm for prediction. In this article, we introduce a corresponding new command, rforest.
Matthias Schonlau, Rosie Yuyan Zou
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Computational Statistics & Data Analysis, 2013 23 pages, 6 ...
Yan, Donghui +2 more
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Gas phase homolytic bond dissociation enthalpies of common laboratory solvents: A G4 theoretical study [PDF]
, 2010 Gas phase standard state (298.15 K, 1 atm) calculations were conducted at the Gaussian-4 (G4) composite method level of theory to estimate the bond dissociation enthalpies (BDEs) of various common laboratory solvents.
Kaya Forest, Sierra Rayne
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Le cinéma en Afrique : l’impossible industrie
Mise au Point, 2012 Film production in Africa encounters numerous difficulties while at the same time theaters close down. An essential prerequisite to the possible adoption of appropriate remedies to this situation is an analysis of the causes which led to the extinction ...
Claude Forest
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