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Journal of Computational Chemistry
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June 15, 2007
Efficiency of numerical basis sets for predicting the binding energies of hydrogen bonded complexes: evidence of small basis set superposition error compared to Gaussian basis sets
Yasuji Inada, Hideo Orita
The Journal of Physical Chemistry. B
|
July 21, 2006
DFT investigation of CO adsorption on Pt(211) and Pt(311) surfaces from low to high coverage
Hideo Orita, Yasuji Inada
The Journal of Physical Chemistry. B
|
July 21, 2006
Studies of NO adsorption on Pt(110)-(1 x 2) and (1 x 1) surfaces using density functional theory
Hideo Orita, Isao Nakamura, Tadahiro Fujitani
The Journal of Chemical Physics
|
January 11, 2005
A density functional study of NO adsorption and decomposition on Ni(211) and Pd(211) surfaces
Hideo Orita, Isao Nakamura, Tadahiro Fujitani
Journal of the American Chemical Society
|
August 10, 2007
Surface structures of rutile TiO2 (011)
Toshitaka Kubo, Hideo Orita, Hisakazu Nozoye
The Journal of Chemical Physics
|
November 10, 2016
Intermolecular interactions of oligothienoacenes: Do S⋯S interactions positively contribute to crystal structures of sulfur-containing aromatic molecules?
Seiji Tsuzuki, Hideo Orita, Naoki Sato
Physical Chemistry Chemical Physics : PCCP
|
August 19, 2011
Atomic structures of the defective SrTiO3 (001) surface
Toshitaka Kubo, Hideo Orita, Hisakazu Nozoye
Langmuir : the ACS Journal of Surfaces and Colloids
|
March 12, 2008
TiO2 band shift by nitrogen-containing heterocycles in dye-sensitized solar cells: a periodic density functional theory study
Hitoshi Kusama, Hideo Orita, Hideki Sugihara
The Journal of Physical Chemistry. B
|
May 6, 2010
First-principles lattice energy calculation of urea and hexamine crystals by a combination of periodic DFT and MP2 two-body interaction energy calculations
Seiji Tsuzuki, Hideo Orita, Kazumasa Honda, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Studies of CO adsorption on Pt(100), Pt(410), and Pt(110) surfaces using density functional theory
Shuichi Yamagishi, Toshiyuki Fujimoto, Yasuji Inada, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
Journal of Computational Chemistry
|
June 15, 2007
Efficiency of numerical basis sets for predicting the binding energies of hydrogen bonded complexes: evidence of small basis set superposition error compared to Gaussian basis sets
Yasuji Inada, Hideo Orita
The Journal of Physical Chemistry. B
|
July 21, 2006
DFT investigation of CO adsorption on Pt(211) and Pt(311) surfaces from low to high coverage
Hideo Orita, Yasuji Inada
The Journal of Physical Chemistry. B
|
July 21, 2006
Studies of NO adsorption on Pt(110)-(1 x 2) and (1 x 1) surfaces using density functional theory
Hideo Orita, Isao Nakamura, Tadahiro Fujitani
The Journal of Chemical Physics
|
January 11, 2005
A density functional study of NO adsorption and decomposition on Ni(211) and Pd(211) surfaces
Hideo Orita, Isao Nakamura, Tadahiro Fujitani
Journal of the American Chemical Society
|
August 10, 2007
Surface structures of rutile TiO2 (011)
Toshitaka Kubo, Hideo Orita, Hisakazu Nozoye
The Journal of Chemical Physics
|
November 10, 2016
Intermolecular interactions of oligothienoacenes: Do S⋯S interactions positively contribute to crystal structures of sulfur-containing aromatic molecules?
Seiji Tsuzuki, Hideo Orita, Naoki Sato
Physical Chemistry Chemical Physics : PCCP
|
August 19, 2011
Atomic structures of the defective SrTiO3 (001) surface
Toshitaka Kubo, Hideo Orita, Hisakazu Nozoye
Langmuir : the ACS Journal of Surfaces and Colloids
|
March 12, 2008
TiO2 band shift by nitrogen-containing heterocycles in dye-sensitized solar cells: a periodic density functional theory study
Hitoshi Kusama, Hideo Orita, Hideki Sugihara
The Journal of Physical Chemistry. B
|
May 6, 2010
First-principles lattice energy calculation of urea and hexamine crystals by a combination of periodic DFT and MP2 two-body interaction energy calculations
Seiji Tsuzuki, Hideo Orita, Kazumasa Honda, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Studies of CO adsorption on Pt(100), Pt(410), and Pt(110) surfaces using density functional theory
Shuichi Yamagishi, Toshiyuki Fujimoto, Yasuji Inada, et al.
Page
of 2