E-LIB Suche - Ergebnisse für: Dunlap, Brett I.

1

Jahn-Teller effect in density-functional theory:

Palenik, Mark C. ; Dunlap, Brett I. ; Gunlycke, Daniel
Physical Review A. 99 (2019) 2 - p. , 2019

2

First-Principles Calculations of Sarin Adsorption on Anatas..:

Le, Nam Q. ; Ekuma, Chinedu E. ; Dunlap, Brett I..
The Journal of Physical Chemistry C. 122 (2018) 5 - p. 2832-2839 , 2018

Link: https://doi.org/10.1021/..

3

Correlated dynamics in aqueous proton diffusion:

Fischer, Sean A. ; Dunlap, Brett I. ; Gunlycke, Daniel
Chemical Science. 9 (2018) 35 - p. 7126-7132 , 2018

Link: https://doi.org/10.1039/..

4

Corrigendum: Proton transport through hydrated chitosan-bas..:

Fischer, Sean A. ; Dunlap, Brett I. ; Gunlycke, Daniel
Journal of Polymer Science Part B: Polymer Physics. 56 (2018) 6 - p. 543-543 , 2018

Link: https://doi.org/10.1002/..

5

Proton transport through hydrated chitosan‐based polymer me..:

Fischer, Sean A. ; Dunlap, Brett I. ; Gunlycke, Daniel
Journal of Polymer Science Part B: Polymer Physics. 55 (2017) 14 - p. 1103-1109 , 2017

Link: https://doi.org/10.1002/..

6

Sb@Ni12@Sb20–/+ and Sb@Pd12@Sb20n Cluster Anions, Where n =..:

Wang, Yi ; Moses-DeBusk, Melanie ; Stevens, Lauren...
Journal of the American Chemical Society. 139 (2017) 2 - p. 619-622 , 2017

Link: https://doi.org/10.1021/..

7

Orbital angular momentum eigenfunctions for fast and numeri..:

Hu, Anguang ; Chan, Nora W. C. ; Dunlap, Brett I.
The Journal of Chemical Physics. 147 (2017) 7 - p. , 2017

Link: https://doi.org/10.1063/..

8

Density perturbation theory:

Palenik, Mark C. ; Dunlap, Brett I.
The Journal of Chemical Physics. 143 (2015) 4 - p. , 2015

Link: https://doi.org/10.1063/..

9

Thermodynamic and kinetic stabilities of CO2 oligomers:

Dunlap, Brett I. ; Schweigert, Igor V. ; Purdy, Andrew P...
The Journal of Chemical Physics. 138 (2013) 13 - p. , 2013

Link: https://doi.org/10.1063/..

10

Smooth scaling of valence electronic properties in fulleren..:

Lewis, Greyson R. ; Bunting, William E. ; Zope, Rajendra R...
Physical Review A. 87 (2013) 5 - p. , 2013

Link: https://doi.org/10.1103/..

11

Effects of dopant clustering in cubic zirconia stabilized b..:

Miller, Steven P. ; Dunlap, Brett I. ; Fleischer, Amy S.
Solid State Ionics. 253 (2013) - p. 130-136 , 2013

Link: https://doi.org/10.1016/..

12

Cation coordination and interstitial oxygen occupancy in co..:

Miller, Steven P. ; Dunlap, Brett I. ; Fleischer, Amy S.
Solid State Ionics. 227 (2012) - p. 66-72 , 2012

Link: https://doi.org/10.1016/..

13

Molecular dynamics simulation of yttria-stabilized zirconia..:

Lau, Kah Chun ; Dunlap, Brett I
Journal of Physics: Condensed Matter. 23 (2011) 3 - p. 035401 , 2011

Link: https://doi.org/10.1088/..

14

Self-consistent, constrained linear-combination-of-atomic-p..:

Dunlap, Brett I. ; Schweigert, Igor V.
The Journal of Chemical Physics. 134 (2011) 4 - p. , 2011

Link: https://doi.org/10.1063/..

15

Self-Consistent-Field Electrochemistry:

Gatewood, Daniel ; Turner, C. Heath ; Dunlap, Brett I.
ECS Transactions. 35 (2011) 1 - p. 1055-1063 , 2011

Link: https://doi.org/10.1149/..