41 Publications (Page 1 of 2)
2022
Plasmon-induced excitation energy transfer in silver nanoparticle dimers: A real-time TDDFTB investigation
Liu, Zhen⋅Liu, Zhen⋅Wong, Bryan M⋅Wong, Bryan M⋅Aikens, Christine M and Aikens, Christine M
The Journal of Chemical Physics, vol. 156, (no. 15), Apr 21, 2022. | Journal Article
2019
Understanding plasmon coupling in nanoparticle dimers using molecular orbitals and configuration interaction
Alkan, Fahri and Aikens, Christine M
Physical Chemistry Chemical Physics : PCCP, vol. 21, (no. 41), pp. 23065-23075, 2019. | Journal Article
2018
Connections Between Theory and Experiment for Gold and Silver Nanoclusters.
Weerawardene, K L Dimuthu M⋅Häkkinen, Hannu and Aikens, Christine M
Annual review of physical chemistry, February 28, 2018. | Journal Article
2016
Gold-doped silver nanocluster [Au3Ag38(SCH2Ph)24X5](2-) (X = Cl or Br).
Wang, Zhi⋅Senanayake, Ravithree⋅Aikens, Christine M⋅Chen, Wen-Miao⋅Tung, Chen-Ho and Sun, Di
Nanoscale, October 17, 2016. | Journal Article
 
Theoretical Insights into Origin of Photoluminescence of Au25(SR)18- Nanoparticles.
Weerawardene, K L Dimuthu M and Aikens, Christine M
Journal of the American Chemical Society, August 15, 2016. | Journal Article
 
Time Dependent Density Functional Theory Study of Magnetic Circular Dichroism Spectra of Gold Clusters Au9(PH3)8(3+) and Au9(PPh3)8(3).
Karimova, Natalia V and Aikens, Christine M
The journal of physical chemistry. A, vol. 120, (no. 48), pp. 9625-9635, December 8, 2016. | Journal Article
2015
Ab initio electronic structure study of a model water splitting dimer complex.
Fernando, Amendra and Aikens, Christine M
Physical chemistry chemical physics : PCCP, vol. 17, (no. 48), pp. 32443-32454, December 28, 2015. | Journal Article
 
Quantum Mechanical Studies of Large Metal, Metal Oxide, and Metal Chalcogenide Nanoparticles and Clusters.
Fernando, Amendra⋅Weerawardene, K L Dimuthu M⋅Karimova, Natalia V and Aikens, Christine M
Chemical reviews, vol. 115, (no. 12), pp. 6112-6216, June 24, 2015. | Journal Article
 
Refined Insights in the Photochromic spiro-Dihydroindolizine/Betaine System.
Fernando, Amendra⋅Malalasekera, Aruni P⋅Yu, Jing⋅Shrestha, Tej B⋅McLaurin, Emily J⋅Bossmann, Stefan H and Aikens, Christine M
The journal of physical chemistry. A, vol. 119, (no. 37), pp. 9621-9629, September 17, 2015. | Journal Article
 
Strong Tunable Visible Absorption Predicted for Polysilo-acenes Using TDDFT Calculations.
Weerawardene, K L Dimuthu M and Aikens, Christine M
The journal of physical chemistry letters, vol. 6, (no. 17), pp. 3341-3345, September 3, 2015. | Journal Article
 
Theoretical examination of solvent and R group dependence in gold thiolate nanoparticle synthesis.
Neidhart, Suzanne M⋅Barngrover, Brian M and Aikens, Christine M
Physical chemistry chemical physics : PCCP, vol. 17, (no. 12), pp. 7676-7680, March 28, 2015. | Journal Article
 
Time-Dependent Density Functional Theory Investigation of the Electronic Structure and Chiroptical Properties of Curved and Helical Silver Nanowires.
Karimova, Natalia V and Aikens, Christine M
The journal of physical chemistry. A, vol. 119, (no. 29), pp. 8163-8173, July 23, 2015. | Journal Article
 
Time-dependent density functional theory study of the luminescence properties of gold phosphine thiolate complexes.
Guidez, Emilie B and Aikens, Christine M
The journal of physical chemistry. A, vol. 119, (no. 14), pp. 3337-3347, April 9, 2015. | Journal Article
 
Water Splitting Processes on Mn4O4 and CaMn3O4 Model Cubane Systems.
Lee, Choongkeun and Aikens, Christine M
The journal of physical chemistry. A, vol. 119, (no. 35), pp. 9325-9337, September 3, 2015. | Journal Article
2014
Au36(SPh)24 nanomolecules: X-ray crystal structure, optical spectroscopy, electrochemistry, and theoretical analysis.
Nimmala, Praneeth Reddy⋅Knoppe, Stefan⋅Jupally, Vijay Reddy⋅Delcamp, Jared H⋅Aikens, Christine M and Dass, Amala
The journal of physical chemistry. B, vol. 118, (no. 49), pp. 14157-14167, December 11, 2014. | Journal Article
 
Chiral electronic transitions in fluorescent silver clusters stabilized by DNA.
Swasey, Steven M⋅Karimova, Natalia⋅Aikens, Christine M⋅Schultz, Danielle E⋅Simon, Anna J and Gwinn, Elisabeth G
ACS nano, vol. 8, (no. 7), pp. 6883-6892, July 22, 2014. | Journal Article
 
Plasmon resonance analysis with configuration interaction.
Guidez, Emilie B and Aikens, Christine M
Physical chemistry chemical physics : PCCP, vol. 16, (no. 29), pp. 15501-15509, August 7, 2014. | Journal Article
 
Quantum coherent plasmon in silver nanowires: A real-time TDDFT study
Guidez, Emilie B⋅Guidez, Emilie B⋅Aikens, Christine M⋅Aikens, Christine M⋅Li, Xiaosong and Li, Xiaosong
The Journal of Chemical Physics, vol. 140, (no. 24), Jun 28, 2014. | Journal Article
 
Quantum mechanical origin of the plasmon: from molecular systems to nanoparticles.
Guidez, Emilie B and Aikens, Christine M
Nanoscale, vol. 6, (no. 20), pp. 11512-11527, October 21, 2014. | Journal Article
 
Water adsorption and dissociation processes on small Mn-doped TiO2 complexes.
Lee, Choongkeun and Aikens, Christine M
The journal of physical chemistry. A, vol. 118, (no. 3), pp. 598-605, January 23, 2014. | Journal Article
2013
Improved ReaxFF force field parameters for Au-S-C-H systems.
Bae, Gyun-Tack and Aikens, Christine M
The journal of physical chemistry. A, vol. 117, (no. 40), pp. 10438-10446, October 10, 2013. | Journal Article
 
Oxidation of gold clusters by thiols.
Barngrover, Brian M and Aikens, Christine M
The journal of physical chemistry. A, vol. 117, (no. 25), pp. 5377-5384, June 27, 2013. | Journal Article
 
Raman spectroscopy: The effect of field gradient on SERS
Aikens, Christine M⋅Aikens, Christine M⋅Madison, Lindsey R⋅Madison, Lindsey R⋅Schatz, George C and Schatz, George C
Nature Photonics, vol. 7, (no. 7), pp. 508-510, Jul 2013. | Journal Article
 
Theoretical investigation of surface reactions of lactic acid on MgO clusters.
Pandey, Lila B and Aikens, Christine M
The journal of physical chemistry. A, vol. 117, (no. 4), pp. 765-770, January 31, 2013. | Journal Article
2012
Development of a charge-perturbed particle-in-a-sphere model for nanoparticle electronic structure
Guidez, Emilie B and Aikens, Christine
Physical Chemistry Chemical Physics, vol. 14, (no. 12), pp. 4287-4295, 2012. | Journal Article