Author:
Sosa Carlos,Schlegel H. Bernhard
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Cited by
28 articles.
订阅此论文施引文献
订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Calculated infrared spectra of nerve agents and simulants;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2012-06
2. Computer Estimation of Chemical Structures from Infrared Spectra;Journal of Computer Chemistry, Japan;2005
3. Vibrational and Quantum Chemical Studies of 1,2-Difluoroethylenes: Spectra of 1,2-13C2H2F2 Species, Scaled Force Fields, and Dipole Derivatives;The Journal of Physical Chemistry A;2002-06-05
4. Prediction of Vibrational Spectra by Computational Chemistry. Ab initio Molecular Orbital Calculation of Vibrational Frequencies and infrared Intensities of Gas Phase Dichloromethane Molecules CH2Cl2, CHDCl2 and CD2Cl2.;Journal of Computer Chemistry, Japan;2002
5. Harmonic frequency scaling factors for Hartree-Fock, S-VWN, B-LYP, B3-LYP, B3-PW91 and MP2 with the Sadlej pVTZ electric property basis set;Theoretical Chemistry Accounts;2001-05-07