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The combined use of ab initio molecular orbital theory and matrix isolation infrared spectroscopy in the study of molecular interactionsGeoffrey A. Yeo; Thomas A. Ford · 1992
The linear and T-shaped isomers of C2H2HCN: Vibrational dynamics from infrared spectroscopy and ab initio theoryP.A. Block; K.W. Jucks; L.G. Pedersen; R.E. Miller · 1989
Infrared Spectroscopy and Ab Initio Theory of Isolated H5O2+: From Buckets of Water to the Schrödinger Equation and BackGereon Niedner-Schatteburg · 2008
ChemInform Abstract: Infrared Spectroscopy and ab initio Theory of Isolated H5O+2: From Buckets of Water to the Schroedinger Equation and BackGereon Niedner-Schatteburg · 2008
The structure of Ar–C2H4 from high resolution infrared spectroscopy and ab initio theory: The twofold barrier to C2H4 internal rotationBlock, P. A.; Pedersen, L. G.; Miller, R. E. · The Journal of Chemical Physics · 1993
Structural determinations for two isomeric forms of nitrous oxide-hydrogen cyanide complexDayton, D. C.; Pedersen, L. G.; Miller, R. E. · The Journal of Physical Chemistry · 1992
Steered transition path samplingGuttenberg, Nicholas; Dinner, Aaron R.; Weare, Jonathan · The Journal of Chemical Physics · 2012
Mixing normal and anomalous diffusionGeyer, Tihamér · The Journal of Chemical Physics · 2012
Perspective: Supercooled liquids and glassesEdiger, M. D.; Harrowell, Peter · The Journal of Chemical Physics · 2012
Microwave Absorption in Compressed CO2Ho, W. · The Journal of Chemical Physics · 1966
Perspective: Nonadiabatic dynamics theoryTully, John C. · The Journal of Chemical Physics · 2012
Thermodynamics of Crystals and MeltingBorn, Max · The Journal of Chemical Physics · 1939
Magnetic Equivalence of Nuclear SpinsMusher, J. I. · The Journal of Chemical Physics · 1967
Equation of State for Hard SpheresThiele, Everett · The Journal of Chemical Physics · 1963