Concepedia
Journal of Molecular Structure THEOCHEM · 2003 · 40 citations · 11 references
Chemical EngineeringEngineeringNatural SciencesChemical StudyChlorine SubstitutionOrganic ChemistryVibrational SpectroscopicQuantum ChemistryChemistryHalogenationSpectra-structure Correlation
11
Density-functional approximation for the correlation energy of the inhomogeneous electron gas
John P. Perdew · Physical review. B, Condensed matter · 1986 · 18.6K citations
Correlation Energy, Engineering, Randomphase Approximation +18
Systematic ab initio gradient calculation of molecular geometries, force constants, and dipole moment derivatives
Péter Pulay, Géza Fogarasi, Frank Pang et al. · Journal of the American Chemical Society · 1979 · 2.1K citations
Engineering, Chemical Analysis, Altmetric Attention Score +17
A comparative study on the vibrational spectroscopy of pyridazine, pyrimidine and pyrazine
Ferenc Billes, Hans Mikosch, Sándor Holly · Journal of Molecular Structure THEOCHEM · 1998 · 89 citations
Molecular Spectroscopy, Natural Sciences, Spectroscopy +8
Vibrational spectra of [1H4]pyrazine and [2H4]pyrazine
Juan F. Arenas, Juan T. López Navarrete, Juan C. Otero et al. · Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics · 1985 · 52 citations
Spectroscopic Method, Vibrational Spectra, Engineering +14
Vibrational spectroscopy of diazoles
Ferenc Billes, Henrietta Endrédi, G. Jalsovszky · Journal of Molecular Structure THEOCHEM · 1999 · 49 citations
Molecular Spectroscopy, Natural Sciences, Spectroscopy +4