Laimutis Bytautas

Chemical Combinatorics for Alkane-Isomer Enumeration and More

Douglas J. Klein, Laimutis Bytautas, D. Klein, 1998, J. Chem. Inf. Comput. Sci..

Mean Wiener Numbers and Other Mean Extensions for Alkane Trees

Douglas J. Klein, Laimutis Bytautas, 2000, J. Chem. Inf. Comput. Sci..

Foldedness in linear polymers: A difference between graphical and Euclidean distances

Tomaz Pisanski, Douglas J. Klein, Milan Randic, 1998, Discrete Mathematical Chemistry.

Correlation energy extrapolation by intrinsic scaling. V. Electronic energy, atomization energy, and enthalpy of formation of water.

Klaus Ruedenberg, Laimutis Bytautas, K. Ruedenberg, 2006, The Journal of chemical physics.

Seniority and orbital symmetry as tools for establishing a full configuration interaction hierarchy.

Laimutis Bytautas, Thomas M Henderson, Gustavo E Scuseria, 2011, The Journal of chemical physics.

Isomer combinatorics for acyclic conjugated polyenes: enumeration and beyond

Douglas J. Klein, Laimutis Bytautas, D. Klein, 1999 .

Accurate potential energy curve for B2. Ab initio elucidation of the experimentally elusive ground state rotation-vibration spectrum.

Klaus Ruedenberg, Laimutis Bytautas, Nikita Matsunaga, 2012, The journal of physical chemistry. A.

All acyclic hydrocarbons: formula periodic table and property overlap plots via chemical combinatorics

Douglas J. Klein, Laimutis Bytautas, T. G. Schmalz, 2000 .

Split-localized orbitals can yield stronger configuration interaction convergence than natural orbitals

Klaus Ruedenberg, Laimutis Bytautas, K. Ruedenberg, 2003 .