| 1 |
Natural linear-scaled coupled-cluster theory with local transferable triple excitations: Applications to peptides
Hughes TF, Flocke N, Bartlett RJ
Journal of Physical Chemistry A, 112(26), 5994, 2008 |
| 2 |
Density functional energetics of alpha-quartz for calibration of SiO2 interatomic potentials
Flocke N, Zhu WM, Trickey SB
Journal of Physical Chemistry B, 109(9), 4168, 2005 |
| 3 |
A natural linear scaling coupled-cluster method
Flocke N, Bartlett RJ
Journal of Chemical Physics, 121(22), 10935, 2004 |
| 4 |
Localized correlation treatment using natural bond orbitals
Flocke N, Bartlett RJ
Chemical Physics Letters, 367(1-2), 80, 2003 |
| 5 |
Correlation energy estimates in periodic extended systems using the localized natural bond orbital coupled cluster approach
Flocke N, Bartlett RJ
Journal of Chemical Physics, 118(12), 5326, 2003 |
| 6 |
Ground and excited Hubbard states for buckminsterfullerene with uniform and alternating bond strengths
Flocke N, Schmalz TG, Klein DJ
Journal of Chemical Physics, 112(19), 8233, 2000 |
| 7 |
Variational resonance valence bond study on the ground state of C-60 using the Heisenberg model
Flocke N, Schmalz TG, Klein DJ
Journal of Chemical Physics, 109(3), 873, 1998 |
