Atomic OrbitalsElectron CloudDensest RegionShapeAngular Momentum Quantum NumberPrincipal Quantum NumberSublevelsS OrbitalP OrbitalD OrbitalF OrbitalEnergy LevelProbability DensityNucleusElectrostatic ForcesRadial Distribution FunctionHydrogen AtomSpherical ShapeRadiusNodes...
- 《Journal of Computational Chemistry》 被引量: 442发表: 1996年 Radial Distribution Functions and the Equation of State of a Fluid Composed of Rigid Spherical Molecules The integral equation for the radial distribution function of a fluid of rigid spherical molecules has been integrated numerically ...
Jurica NovakMaria A GrishinaVladimir A PotemkinJohann GasteigerHigher Medical and Biological School Laboratory of Computational Modeling of Drugs South UralFuture medicinal chemistry
An equation is given for the radial distribution function (hereafter the rdf) of a dense Lennard-Jones fluid. The equation explicitly expresses the rdf as ... Goldman,Saul. - 《Journal of Physical Chemistry》 被引量: 22发表: 1979年
Analytical accurate expressions for radial distribution function and equation of state of hard sphere fluid based on the Percus-Yevick exact solution and a new unifying closure Mehrdad Khanpour Physics and Chemistry of Liquids Jan 2023 ABSTRACTABSTRACTNew accurate analytic expressions for the radial dis...
Effects of shear rates on radial distribution of different types of heavy particles in light media LI Jing-sheng(李敬生), WANG Juan(王娟), SHEN Qin(沈琴), ZHENG Ning-ning(郑宁宁) (School of Chemistry and Chemical Engineering, Jiangsu University, Zhenjiang 212013, China) ...
The Radial Distribution Function (RDF) approach has been applied to the study of the chick intestinal VDR affinity of 49 Vitamin D analogues. A model able to describe more than 77.5% of the variance in the experimental activity was developed with the use of the mentioned approach. In contrast...
191-192 Department of Theoretical Chemistry, Institute of Chemistry, UMCS, Lublin (Poland) Short Information On Some Rational Bases of Hollerlan's Unit Compressibility Law and its Relation to the Radial Distribution Function By W. Rudzinski and S. Sokolowski1 (Received 20th May 1976) Abstract The...
The atomic radial distribution function of vitreous AgGeAsSe3, obtained based on the experimental intensity curves taken with monochromatic copper and moly... KB Aleinikova,EN Zinchenko,NV Melnikova - Glass Physics and Chemistry: A Journal on the Structural, Physical, and Chemical Properties and Nat...
Molecular Physics: An International Journal at the Interface Between Chemistry and Physics Volume 105, Issue 17-18, 2007 Translator disclaimer Selective-pivot sampling of radial distribution functions in asymmetric liquid mixtures PreviewView full textDownload full text Access options DOI: 10.1080/0026...