Improved model for the refractive index: application to potential components of ambient aerosol

Atom Pair Contribution Method: Fast and General Procedure To Predict Molecular Formation Enthalpies

(2018) Didier Mathieu   Journal of Chemical Information and Modeling

Enhanced Light Scattering of Secondary Organic Aerosols by Multiphase Reactions

(2017) Kun Li et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Group Contribution Approach To Predict the Refractive Index of Pure Organic Components in Ambient Organic Aerosol

(2017) Chen Cai et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Predicting the Surface Tension of Liquids: Comparison of Four Modeling Approaches and Application to Cosmetic Oils

(2017) Valentin Goussard et al.   Journal of Chemical Information and Modeling

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

(2017) Egon L. Willighagen et al.   Journal of Cheminformatics

Optical Properties of Secondary Organic Aerosol from cis-3-Hexenol and cis-3-Hexenyl Acetate: Effect of Chemical Composition, Humidity, and Phase

(2016) Rebecca M. Harvey et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Reliable and Versatile Model for the Density of Liquids Based on Additive Volume Increments

(2016) Didier Mathieu et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Comparison of Methods for Predicting the Compositional Dependence of the Density and Refractive Index of Organic–Aqueous Aerosols

(2016) Chen Cai et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Optical Properties of Secondary Organic Aerosols and Their Changes by Chemical Processes

(2015) Tamar Moise et al.   CHEMICAL REVIEWS

QSPR study on refractive indices of solvents commonly used in polymer chemistry using flexible molecular descriptors

(2015) S.E. Fioressi et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

Additive models for the molecular polarizability and volume

(2014) Shamus A. Blair et al.   CHEMICAL PHYSICS LETTERS

A chemical structure based model for the estimation of refractive indices of organic compounds

(2014) Farhad Gharagheizi et al.   FLUID PHASE EQUILIBRIA

Prediction of Gurney Parameters Based on an Analytic Description of the Expanding Products

(2014) Didier Mathieu   Journal of Energetic Materials

Insight into the contribution of individual functional groups to the flash point of organic compounds

(2014) Didier Mathieu et al.   JOURNAL OF HAZARDOUS MATERIALS

Volatility and Oxidative Aging of Aqueous Maleic Acid Aerosol Droplets and the Dependence on Relative Humidity

(2014) Benjamin J. Dennis-Smither et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Power Law Expressions for Predicting Lower and Upper Flammability Limit Temperatures

(2013) Didier Mathieu   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

The chemical evolution & physical properties of organic aerosol: A molecular structure based approach

(2012) Yiyi Wei et al.   ATMOSPHERIC ENVIRONMENT

Flash Points of Organosilicon Compounds: How Data for Alkanes Combined with Custom Additive Fragments Can Expedite the Development of Predictive Models

(2012) Didier Mathieu   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Simple Alternative to Neural Networks for Predicting Sublimation Enthalpies from Fragment Contributions

(2012) Didier Mathieu   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Variations in organic aerosol optical and hygroscopic properties upon heterogeneous OH oxidation

(2011) Christopher D. Cappa et al.   JOURNAL OF GEOPHYSICAL RESEARCH

Densities and Apparent Molar Volumes of Atmospherically Important Electrolyte Solutions. 1. The Solutes H2SO4, HNO3, HCl, Na2SO4, NaNO3, NaCl, (NH4)2SO4, NH4NO3, and NH4Cl from 0 to 50 °C, Including Extrapolations to Very Low Temperature and to the Pure Liquid State, and NaHSO4, NaOH, and NH3at 25 °C

(2011) S. L. Clegg et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Evaluation of a quantitative structure–property relationship (QSPR) for predicting mid-visible refractive index of secondary organic aerosol (SOA)

(2011) Haley Redmond et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Quantitative Correlation of Physical and Chemical Properties with Chemical Structure: Utility for Prediction

(2010) Alan R. Katritzky et al.   CHEMICAL REVIEWS

PaDEL-descriptor: An open source software to calculate molecular descriptors and fingerprints

(2010) Chun Wei Yap   JOURNAL OF COMPUTATIONAL CHEMISTRY

Relationship of refractive index to mass density and self-consistency of mixing rules for multicomponent mixtures like ambient aerosols

(2008) Yangang Liu et al.   JOURNAL OF AEROSOL SCIENCE