Related references
Note: Only part of the references are listed.A Priori Prediction of Heats of Vaporization and Sublimation by EFP2-MD
Manik Kumer Ghosh et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2014)
Prediction of Density and Viscosity of Biofuel Compounds Using Machine Learning Methods
Diego Alonso Saldana et al.
ENERGY & FUELS (2012)
Application of Molecular Dynamics Simulations in Molecular Property Prediction II: Diffusion Coefficient
Junmei Wang et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)
Quantitative Correlation of Physical and Chemical Properties with Chemical Structure: Utility for Prediction
Alan R. Katritzky et al.
CHEMICAL REVIEWS (2010)
An electrostatic interaction correction for improved crystal density prediction
Peter Politzer et al.
MOLECULAR PHYSICS (2009)
Prediction of densities for solid energetic molecules with molecular surface electrostatic potentials
Chan Kyung Kim et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Updated atom/functional group and atom_code volume additivity parameters for the calculation of crystal densities of single molecules, organic salts, and multi-fragment materials containing H, C, B, N, O, F, S, P, Cl, Br, and I
Herman L. Ammon
PROPELLANTS EXPLOSIVES PYROTECHNICS (2008)
Accurate predictions of crystal densities using quantum mechanical molecular volumes
Betsy M. Rice et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Crystal density predictions for nitramines based on quantum chemistry
Ling Qiu et al.
JOURNAL OF HAZARDOUS MATERIALS (2007)
New atom/functional group volume additivity data bases for the calculation of the crystal densities of C-, H-, N-, O-, F-, S-, P-, Cl-, and Br-containing compounds
HL Ammon
STRUCTURAL CHEMISTRY (2001)
A five-site model for liquid water and the reproduction of the density anomaly by rigid, nonpolarizable potential functions
MW Mahoney et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
Share Paper
