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https://doi.org/10.2139/ssrn.3949249

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Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/jcc.22885openalex-extracted
Multiwfn: A multifunctional wavefunction analyzer
inferredcites →https://doi.org/10.1016/j.molliq.2017.08.098openalex-extracted
Electronic structure, FT-IR analysis and nematic behaviour studies of para-methoxybenzylidine p-ethylaniline: Ab-initio and DFT approach
inferredcites →https://doi.org/10.1016/j.molliq.2019.111672openalex-extracted
In-silico investigation of optical, thermal and electronic properties for 4-n-alkoxy benzoic acid series (nOBA; n = 1–8)
inferredcites →https://doi.org/10.1016/j.molstruc.2005.01.027openalex-extracted
The Cologne Database for Molecular Spectroscopy, CDMS: a useful tool for astronomers and spectroscopists
inferredcites →https://doi.org/10.1016/s0009-2614(97)00799-9openalex-extracted
Chemical hardnesses of atoms and molecules from frontier orbitals
inferredcites →https://doi.org/10.1016/s0927-0256(03)00111-3openalex-extracted
A generalized synchronous transit method for transition state location
inferredcites →https://doi.org/10.1021/cr990029popenalex-extracted
Conceptual Density Functional Theory
inferredcites →https://doi.org/10.1021/ja983494xopenalex-extracted
Electrophilicity Index
inferredcites →https://doi.org/10.1021/jp953748qopenalex-extracted
Current Status of Transition-State Theory
inferredcites →https://doi.org/10.1051/0004-6361/200811550openalex-extracted
Increased complexity in interstellar chemistry: detection and chemical modeling of ethyl formate andn-propyl cyanide in Sagittarius B2(N)
inferredcites →https://doi.org/10.1063/1.436185openalex-extracted
Electronegativity: The density functional viewpoint
inferredcites →https://doi.org/10.1080/15421406.2019.1641987openalex-extracted
Evolution of Anisotropy, First Order Hyperpolarizability and Electronic Parameters in p-Alkyl-p’-Cynobiphenyl Series of Liquid Crystals: Odd-Even Effect Revisited
inferredcites →https://doi.org/10.1086/513141openalex-extracted
Mechanisms of Amino Acid Formation in Interstellar Ice Analogs
inferredcites →https://doi.org/10.1103/physreva.38.3098openalex-extracted
Density-functional exchange-energy approximation with correct asymptotic behavior
inferredcites →https://doi.org/10.1103/physrevb.37.785openalex-extracted
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
inferredcites →https://doi.org/10.1126/science.1256678openalex-extracted
Detection of a branched alkyl molecule in the interstellar medium: iso -propyl cyanide
inferredcites →https://doi.org/10.1680/jemmr.15.00052openalex-extracted
Electronic structure and vibrational spectra of 1OCB liquid crystal: a DFT study
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