Soft X-ray spectroscopy and spectromicroscopy studies of organic molecules in the environment
SCB Myneni - Reviews in Mineralogy and Geochemistry, 2002 - pubs.geoscienceworld.org
Organic molecules are found everywhere and play an important role in almost all
biogeochemical processes occurring on the surface of the Earth (Aiken et al. 1985; Thurman …
biogeochemical processes occurring on the surface of the Earth (Aiken et al. 1985; Thurman …
Time-dependent density functional theory calculations of the spectroscopy of core electrons
NA Besley, FA Asmuruf - Physical Chemistry Chemical Physics, 2010 - pubs.rsc.org
Recent advances in X-ray sources have led to a renaissance in spectroscopic techniques in
the X-ray region. These techniques that involve the excitation of core electrons can provide …
the X-ray region. These techniques that involve the excitation of core electrons can provide …
Attaching organic layers to semiconductor surfaces
SF Bent - The Journal of Physical Chemistry B, 2002 - ACS Publications
Methods that can be used to tailor the surface properties of semiconductors will become
increasingly important as new applications for semiconductor-based materials continue to …
increasingly important as new applications for semiconductor-based materials continue to …
Holographic reconstruction of photoelectron diffraction and its circular dichroism for local structure probing
F Matsui, T Matsushita, H Daimon - Journal of the Physical Society of …, 2018 - journals.jps.jp
The local atomic structure around a specific element atom can be recorded as a
photoelectron diffraction pattern. Forward focusing peaks and diffraction rings around them …
photoelectron diffraction pattern. Forward focusing peaks and diffraction rings around them …
Reactions of methylamines at the Si (100)-2× 1 surface
We have investigated the room temperature adsorption of methylamine, dimethylamine and
trimethylamine using density functional theory (DFT) and multiple internal reflection Fourier …
trimethylamine using density functional theory (DFT) and multiple internal reflection Fourier …
Adsorption geometries and vibrational modes of on the Si(001) surface
Y Morikawa - Physical Review B, 2001 - APS
Adsorption geometries and vibrational modes of C 2 H 2 on the Si (001) surface are studied
by means of density-functional theory within the generalized gradient approximation. By …
by means of density-functional theory within the generalized gradient approximation. By …
Time-dependent density functional theory study of the X-ray absorption spectroscopy of acetylene, ethylene, and benzene on Si (100)
The carbon 1s X-ray absorption spectroscopy (XAS) of acetylene, ethylene, and benzene in
gas phase and adsorbed on the Si (100) surface is studied using time-dependent density …
gas phase and adsorbed on the Si (100) surface is studied using time-dependent density …
Diradical mechanisms for the cycloaddition reactions of 1, 3-butadiene, benzene, thiophene, ethylene, and acetylene on a Si (111)-7× 7 surface
The cycloaddition chemistry of several representative unsaturated hydrocarbons (1, 3-
butadiene, benzene, ethylene, and acetylene) and a heterocyclic aromatic (thiophene) on a …
butadiene, benzene, ethylene, and acetylene) and a heterocyclic aromatic (thiophene) on a …
Spectroscopic analysis of small organic molecules: A comprehensive near-edge X-ray-absorption fine-structure study of C6-ring-containing molecules
We report high-resolution C 1 s near-edge x-ray-absorption fine-structure (NEXAFS) spectra
of the C 6-ring-containing molecules benzene (C 6 H 6), 1, 3-and 1, 4-cyclohexadiene (C 6 …
of the C 6-ring-containing molecules benzene (C 6 H 6), 1, 3-and 1, 4-cyclohexadiene (C 6 …
Site‐specific reactivity of ethylene at distorted dangling‐bond configurations on Si (001)
Differences in adsorption and reaction energetics for ethylene on Si (001) are reported with
respect to distorted dangling‐bond configurations induced by hydrogen precoverage, as …
respect to distorted dangling‐bond configurations induced by hydrogen precoverage, as …