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2-chlorophenol adsorption on Cu(100): first-principles density functional study
- Altarawneh, Mohammednoor, Radny, Marian W., Smith, Phillip V., Mackie, John C., Kennedy, Eric M., Dlugogorski, Bogdan Z.
A first-principles density functional study of chlorophenol adsorption on Cu₂O(110):CuO
- Altarawneh, Mohammednoor, Radny, Marian W., Smith, Phillip V., Mackie, John C., Kennedy, Eric M., Dlugogorski, Bogdan Z., Soon, Aloysius, Stampfl, Catherine
Acetone on silicon (001): ambiphilic molecule meets ambiphilic surface
- Warschkow, Oliver, Gao, Irene, Schofield, Steven R., Belcher, Daniel R., Radny, Marian W., Saraireh, Sherin A., Smith, Phillip V.
Adsorption of corannulene on graphene
- Sripaturad, Panyada, Thamwattana, Ngamta, Karton, Amir, Stevens, Kyle, Baowan, Duangkamon
- Brown, Joshua J., Page, Alister J.
- Palliyarayil, Ansari, Selvarajan, Premkumar, Prakash, Pavan Seethur, Sathish, C. I., Dasireddy, Venkata D. B. C., Vinu, Ajayan, Kumar, Nallaperumal Shunmuga, Sil, Sanchita
An introduction to the calculation of valence EELS: quantum mechanical methods for bulk solids
Applications and theoretical simulation of low-loss electron energy-loss spectra
Atomic and electronic structure of the K/Si(111)√3x√3R30°-B chemisorption system
- Shi, H. Q., Radny, M. W., Smith, P. V.
Atomic and electronic stucture of the Si(001)2x2-Li chemisorption system at 0.5 monolayer coverage
- Shi, H. Q., Radny, M. W., Smith, P. V.
Binding sites for SiH₂/Si(0 0 1): a combined ab initio, tight-binding, and classical investigation
- Cereda, S., Montalenti, F., Cogoni, M., Branduardi, D., Radny, M. W., Smith, P. V., Miglio, Leo
Bonding and electronics of the MoTe₂/Ge interface under strain
- Szary, Maciej J., Michalewicz, Marek T., Radny, Marian W.
Carbonyl mediated attachment to silicon: acetaldehyde on Si(001)
- Belcher, Daniel R., Schofield, Steven R., Warschkow, Oliver, Radny, Marian W., Smith, Phillip V.
Clean and metal-doped bundles of boron-carbide nanotubes: a density functional study
- Ponomarenko, O., Radny, M. W., Smith, P. V.
Computational defect engineering of d⁰ oxide & oxynitride photocatalysts
Convergence rate analysis of Gaussian belief propagation for Markov networks
- Karakatsani, Sofia, Ge, Qingfeng, Gladys, Michael J., Held, Geog, King, David A.
Dechlorination and defluorination capability of sulfidized nanoscale zerovalent iron with suppressed water reactivity
- Cao, Zhen, Xu, Jiang, Li, Hao, Ma, Tianyi, Lou, Liping, Henkelman, Graeme, Xu, Xinhua
Defects Engineering Induced Ultrahigh Magnetization in Rare Earth Element Nd-doped MoS
- Ding, Xiang, Cui, Xiangyuan, Sohail, Ahmed, Murmu, Peter P., Kennedy, John, Bao, Nina, Ding, Jun, Liu, Rong, Peng, Mingli, Wang, Lan, Chu, Xueze, Vinu, Ajayan, Ringer, Simon P., Yi, Jiabao
Doping and STM tip-induced changes to single dangling bonds on Si(0 0 1)
- Reusch, T. C. G, Warschkow, O., Radny, M. W., Smith, P. V., Marks, N. A., Curson, N. J., McKenzie, D. R., Simmons, M. Y.
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