| 1 |
The 6-31B(d) basis set and the BMC-QCISD and BMC-CCSD multicoefficient correlation methods
Lynch BJ, Zhao Y, Truhlar DG
Journal of Physical Chemistry A, 109(8), 1643, 2005 |
| 2 |
Small representative benchmarks for thermochernical calculations (vol 107A, pg 8997, 2003)
Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 108(8), 1460, 2004 |
| 3 |
Development and assessment of a new hybrid density functional model for thermochemical kinetics
Zhao Y, Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 108(14), 2715, 2004 |
| 4 |
Doubly hybrid meta DFT: New multi-coefficient correlation and density functional methods for thermochemistry and thermochemical kinetics
Zhao Y, Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 108(21), 4786, 2004 |
| 5 |
Effectiveness of diffuse basis functions for calculating relative energies by density functional theory
Lynch BJ, Zhao Y, Truhlar DG
Journal of Physical Chemistry A, 107(9), 1384, 2003 |
| 6 |
Robust and affordable multicoefficient methods for thermochemistry and thermochemical kinetics: The MCCM/3 suite and SAC/3
Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 107(19), 3898, 2003 |
| 7 |
Small representative benchmarks for thermochemical calculations
Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 107(42), 8996, 2003 |
| 8 |
Obtaining the right orbitals is the first step to calculating accurate binding energies for Cu+ ion
Lynch BJ, Truhlar DG
Chemical Physics Letters, 361(3-4), 251, 2002 |
| 9 |
What are the best affordable multi-coefficient strategies for calculating transition state geometries and barrier heights?
Lynch BJ, Truhlar DG
Journal of Physical Chemistry A, 106(5), 842, 2002 |
| 10 |
Dynamics of 1,2-hydrogen migration in carbenes and ring expansion in cyclopropylcarbenes
Albu TV, Lynch BJ, Truhlar DG, Goren AC, Hrovat DA, Borden WT, Moss RA
Journal of Physical Chemistry A, 106(21), 5323, 2002 |
