Comparing the accuracy of perturbative and variational calculations for predicting fundamental vibrational frequencies of dihalomethanes von Krasnoshchekov, Sergey V., Schutski, Roman S., Craig, Norman C., Sibaev, Marat, Crittenden, Deborah L.

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High Level ab Initio Energies and Structures for the Rotamers of 1,3-Butadiene von Feller, David, Craig, Norman C

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Anharmonic Vibrational Analysis of the Infrared and Raman Gas-Phase Spectra of s‑trans- and s‑gauche-1,3-Butadiene von Krasnoshchekov, Sergey V, Craig, Norman C, Boopalachandran, Praveenkumar, Laane, Jaan, Stepanov, Nikolay F

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Electron Delocalization in Polyenes: A Semiexperimental Equilibrium Structure for (3E)‑1,3,5-Hexatriene and Theoretical Structures for (3Z,5Z)‑, (3E,5E)‑, and (3E,5Z)‑1,3,5,7-Octat... von Craig, Norman C, Demaison, Jean, Groner, Peter, Rudolph, Heinz Dieter, Vogt, Natalja

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Anharmonic Vibrational Analysis of the Gas-Phase Infrared Spectrum of 1,1-Difluoroethylene Using the Operator Van Vleck Canonical Perturbation Theory von Krasnoshchekov, Sergey V, Craig, Norman C, Stepanov, Nikolay F

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Gas-Phase Raman Spectra of s-trans- and s-gauche-1,3-Butadiene and Their Deuterated Isotopologues von Boopalachandran, Praveenkumar, Craig, Norman C, Laane, Jaan

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Accurate Equilibrium Structures for Piperidine and Cyclohexane von Demaison, Jean, Craig, Norman C, Groner, Peter, Écija, Patricia, Cocinero, Emilio J, Lesarri, Alberto, Rudolph, Heinz Dieter

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Anharmonic vibrational analysis of s-trans and s-cis conformers of acryloyl fluoride using numerical-analytic Van Vleck operator perturbation theory von Krasnoshchekov, Sergey V., Craig, Norman C., Koroleva, Lidiya A., Stepanov, Nikolay F.

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Semiexperimental Equilibrium Structure of the Lower Energy Conformer of Glycidol by the Mixed Estimation Method von Demaison, Jean, Craig, Norman C, Conrad, Andrew R, Tubergen, Michael J, Rudolph, Heinz Dieter

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Ab Initio Coupled Cluster Determination of the Equilibrium Structures of cis- and trans-1,2-Difluoroethylene and 1,1-Difluoroethylene von Feller, David, Craig, Norman C, Groner, Peter, McKean, Donald C

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Weak Acidity of Vinyl CH Bonds Enhanced by Halogen Substitution von Craig, Norman C, Matlin, Albert R

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Semiexperimental Equilibrium Structures for the Equatorial Conformers of N‑Methylpiperidone and Tropinone by the Mixed Estimation Method von Demaison, Jean, Craig, Norman C, Cocinero, Emilio J, Grabow, Jens-Uwe, Lesarri, Alberto, Rudolph, Heinz Dieter

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Fourier Transform Microwave Spectrum of Propene-3-d1 (CH2═CHCH2D), Quadrupole Coupling Constants of Deuterium, and a Semiexperimental Equilibrium Structure of Propene von Demaison, Jean, Craig, Norman C, Gurusinghe, Ranil, Tubergen, Michael J, Rudolph, Heinz Dieter, Coudert, Laurent H, Szalay, Péter G, Császár, Attila G

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Semiexperimental Equilibrium Structure for cis,trans-1,4-Difluorobutadiene by the Mixed Estimation Method von Demaison, Jean F, Craig, Norman C

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Scaled Quantum Chemical Force Fields for 1,1-Difluorocyclopropane and the Influence of Vibrational Anharmonicity von McKean, Donald C, Craig, Norman C, Law, Mark M

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Fourier Transform Microwave Spectrum of Propene-3‑d 1 (CH2CHCH2D), Quadrupole Coupling Constants of Deuterium, and a Semiexperimental Equilibrium Structure of Propene von Demaison, Jean, Craig, Norman C, Gurusinghe, Ranil, Tubergen, Michael J, Rudolph, Heinz Dieter, Coudert, Laurent H, Szalay, Péter G, Császár, Attila G

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An Investigation of the Rotamers of Butadiene by High-Resolution Infrared Spectroscopy von Craig, Norman C, Sams, Robert L

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Analysis of the Rotational Structure in the High-Resolution Infrared Spectrum of trans-Hexatriene-1-13C1: A Semiexperimental Equilibrium Structure for the C6 Backbone of trans-Hexa... von Craig, Norman C, Tian, Hengfeng, Blake, Thomas A

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Criteria for Spontaneous Processes Derived from the Global Point of View von Gislason, Eric A, Craig, Norman C

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Semiexperimental Equilibrium Structures for cis,cis- and trans,trans-1,4-Difluorobutadiene by the Mixed Estimation Method and Definitive Relative Energies of the Isomers von Demaison, Jean, Császár, Attila G, Groner, Peter, Rudolph, Heinz Dieter, Craig, Norman C

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