Refinement and Parametrization of COSMO-RS

Article Properties
  • Language
    English
  • DOI (url)
  • Publication Date
    1998/06/01
  • Indian UGC (journal)
  • Refrences
    31
  • Citations
    1,503
  • Andreas Klamt Bayer AG, IM-FA, Q18, D-51368 Leverkusen, Germany
  • Volker Jonas Bayer AG, IM-FA, Q18, D-51368 Leverkusen, Germany
  • Thorsten Bürger Bayer AG, IM-FA, Q18, D-51368 Leverkusen, Germany
  • John C. W. Lohrenz Bayer AG, IM-FA, Q18, D-51368 Leverkusen, Germany
Refrences
Title Journal Journal Categories Citations Publication Date
First principles implementation of solvent effects without outlying charge error

The Journal of Chemical Physics
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
189 1997
New Model for Calculation of Solvation Free Energies:  Correction of Self-Consistent Reaction Field Continuum Dielectric Theory for Short-Range Hydrogen-Bonding Effects The Journal of Physical Chemistry 876 1996
On the Validity of Electrostatic Linear Response in Polar Solvents The Journal of Physical Chemistry 217 1996
Treatment of the outlying charge in continuum solvation models

The Journal of Chemical Physics
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
726 1996
A Universal Organic Solvation Model The Journal of Organic Chemistry
  • Science: Chemistry: Organic chemistry
  • Science: Chemistry: Analytical chemistry
  • Technology: Chemical technology: Polymers and polymer manufacture
  • Science: Chemistry
83 1996
Refrences Analysis
The category Science: Chemistry: Physical and theoretical chemistry 16 is the most frequently represented among the references in this article. It primarily includes studies from The Journal of Chemical Physics and The Journal of Physical Chemistry. The chart below illustrates the number of referenced publications per year.
Refrences used by this article by year
Citations
Title Journal Journal Categories Citations Publication Date
Stability of the Protactinium(V) Mono‐Oxo Cation Probed by First‐Principle Calculations

Chemistry – A European Journal
  • Science: Chemistry: General. Including alchemy
  • Science: Chemistry
2024
Limiting factors in the accuracy of DFT calculation for redox potentials

Journal of Computational Chemistry
  • Science: Chemistry: General. Including alchemy
  • Science: Chemistry
2024
Prediction of Greenhouse Gas Solubility in Eutectic Solvents Using COSMO-RS International Journal of Thermophysics
  • Science: Physics: Heat: Thermodynamics
  • Science: Chemistry: Physical and theoretical chemistry
  • Technology: Engineering (General). Civil engineering (General): Mechanics of engineering. Applied mechanics
  • Science: Physics
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
2024
Separation of Ethyl Acetate and Ethanol Azeotropic System by Acetate-Based Ionic Liquid Journal of Solution Chemistry
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
2024
Unraveling the sorption mechanisms of ciprofloxacin on the surface of zeolite 4A (001) in aqueous medium by DFT and MC approaches Applied Surface Science Advances
  • Science: Chemistry: Physical and theoretical chemistry
  • Technology: Electrical engineering. Electronics. Nuclear engineering: Materials of engineering and construction. Mechanics of materials
  • Science: Physics
  • Science: Physics
3 2024
Citations Analysis
Category Category Repetition
Science: Chemistry1,257
Science: Chemistry: Physical and theoretical chemistry537
Technology: Chemical technology: Chemical engineering369
Science: Chemistry: General. Including alchemy337
Science: Physics: Atomic physics. Constitution and properties of matter269
Science: Chemistry: Analytical chemistry131
Science: Physics: Heat: Thermodynamics131
Science: Chemistry: Inorganic chemistry117
Science: Physics: Nuclear and particle physics. Atomic energy. Radioactivity102
Science: Biology (General)100
Science: Physics73
Science: Chemistry: Organic chemistry72
Technology: Chemical technology: Polymers and polymer manufacture70
Technology: Environmental technology. Sanitary engineering67
Science: Mathematics: Instruments and machines: Electronic computers. Computer science61
Geography. Anthropology. Recreation: Environmental sciences54
Medicine: Therapeutics. Pharmacology45
Technology: Engineering (General). Civil engineering (General)45
Technology: Chemical technology44
Science: Chemistry: Organic chemistry: Biochemistry41
Science: Biology (General): Ecology41
Technology: Mechanical engineering and machinery: Renewable energy sources35
Technology: Engineering (General). Civil engineering (General): Environmental engineering34
Technology: Electrical engineering. Electronics. Nuclear engineering: Materials of engineering and construction. Mechanics of materials33
Social Sciences: Industries. Land use. Labor: Special industries and trades: Energy industries. Energy policy. Fuel trade30
Medicine: Public aspects of medicine: Toxicology. Poisons29
Science: Chemistry: Crystallography24
Science: Science (General)20
Science: Science (General): Cybernetics: Information theory20
Science15
Science: Mathematics13
Science: Geology13
Medicine: Medicine (General): Computer applications to medicine. Medical informatics13
Technology: Chemical technology: Food processing and manufacture9
Technology: Home economics: Nutrition. Foods and food supply8
Agriculture8
Agriculture: Agriculture (General)8
Technology: Mining engineering. Metallurgy8
Technology: Chemical technology: Biotechnology7
Technology: Mechanical engineering and machinery7
Medicine6
Science: Physics: Meteorology. Climatology6
Medicine: Medicine (General)4
Medicine: Pharmacy and materia medica3
Agriculture: Plant culture2
Science: Microbiology2
Geography. Anthropology. Recreation: Oceanography2
Agriculture: Aquaculture. Fisheries. Angling2
Technology: Chemical technology: Textile bleaching, dyeing, printing, etc.2
Technology: Electrical engineering. Electronics. Nuclear engineering: Nuclear engineering. Atomic power2
Technology: Building construction: Architectural engineering. Structural engineering of buildings1
Medicine: Internal medicine: Infectious and parasitic diseases1
Medicine: Internal medicine: Special situations and conditions: Arctic medicine. Tropical medicine1
Technology: Technology (General): Industrial engineering. Management engineering: Applied mathematics. Quantitative methods1
Science: Botany1
Agriculture: Animal culture1
Science: Botany: Plant ecology1
Science: Astronomy: Astrophysics1
Medicine: Internal medicine: Special situations and conditions: Industrial medicine. Industrial hygiene1
Social Sciences: Industries. Land use. Labor: Economic growth, development, planning1
Science: Physics: Acoustics. Sound1
Technology: Electrical engineering. Electronics. Nuclear engineering: Electronics1
Agriculture: Forestry1
Technology: Engineering (General). Civil engineering (General): Mechanics of engineering. Applied mechanics1
Technology: Chemical technology: Clay industries. Ceramics. Glass1
Geography. Anthropology. Recreation: Physical geography1
The category Science: Chemistry 1,257 is the most commonly referenced area in studies that cite this article. The first research to cite this article was titled Solvent effects on an SN2 reaction profile and was published in 1998. The most recent citation comes from a 2024 study titled What triggers the coupling of proton transfer and electron transfer at the active site of nitrogenase?. This article reached its peak citation in 2021, with 129 citations. It has been cited in 314 different journals, 10% of which are open access. Among related journals, the Industrial & Engineering Chemistry Research cited this research the most, with 91 citations. The chart below illustrates the annual citation trends for this article.
Citations used this article by year