Identification and treatment of internal rotation in normal mode vibrational analysisAyala, Philippe Y.; Schlegel, H. Bernhard · The Journal of Chemical Physics · 1998

A combined method for determining reaction paths, minima, and transition state geometriesAyala, Philippe Y.; Schlegel, H. Bernhard · The Journal of Chemical Physics · 1997

Using redundant internal coordinates to optimize equilibrium geometries and transition statesPeng, Chunyang; Ayala, Philippe Y.; Schlegel, H. Bernhard; Frisch, Michael J. · Journal of Computational Chemistry · 1996

Dissociative Electron Transfer, Substitution, and Borderline Mechanisms in Reactions of Ketyl Radical Anions. Differences and Difficulties in Their Reaction PathsShaik, Sason; Danovich, David; Sastry, G. Narahari; Ayala, Philippe Y.; Schlegel, H. Bernhard · Journal of the American Chemical Society · 1997

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