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The Journal of Chemical Physics
|
September 28, 2004
Atomic force algorithms in density functional theory electronic-structure techniques based on local orbitals
T Miyazaki, D R Bowler, R Choudhury, et al.
Journal of the Royal Society, Interface
|
September 27, 2013
Density-functional theory study of gramicidin A ion channel geometry and electronic properties
Milica Todorović, David R Bowler, Michael J Gillan, et al.
Journal of Chemical Theory and Computation
|
July 18, 2017
Efficient Calculation of Electronic Structure Using O(N) Density Functional Theory
Ayako Nakata, Yasunori Futamura, Tetsuya Sakurai, et al.
Journal of Chemical Theory and Computation
|
November 27, 2015
Non-self-consistent Density-Functional Theory Exchange-Correlation Forces for GGA Functionals
Antonio S Torralba, David R Bowler, Tsuyoshi Miyazaki, et al.
The Review of Scientific Instruments
|
April 6, 2013
Arbitrary waveform generator for quantum information processing with trapped ions
R Bowler, U Warring, J W Britton, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 5, 2018
Structural properties of silicon-germanium and germanium-silicon core-shell nanowires
Conn O'Rourke, Shereif Y Mujahed, Chathurangi Kumarasinghe, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
June 22, 2011
Correlated electron-ion dynamics with open boundaries: formalism
D R Bowler, Andrew P Horsfield, Cristián G Sánchez, et al.
Angewandte Chemie (International Ed. in English)
|
February 16, 2010
DNA analysis by dynamic chemistry
Frank R Bowler, Juan J Diaz-Mochon, Michael D Swift, et al.
Journal of Computational Chemistry
|
June 27, 2020
Blue moon ensemble simulation of aquation free energy profiles applied to mono and bifunctional platinum anticancer drugs
Teruo Hirakawa, David R Bowler, Tsuyoshi Miyazaki, et al.
Physical Review Letters
|
January 15, 2021
Insight into the Charge Density Wave Gap from Contrast Inversion in Topographic STM Images
M Spera, A Scarfato, Á Pásztor, et al.
Page
of 11
Search research articles
Search
Showing results (41-50 of 108) with videos related to
Sort By:
Page
of 11
The Journal of Chemical Physics
|
September 28, 2004
Atomic force algorithms in density functional theory electronic-structure techniques based on local orbitals
T Miyazaki, D R Bowler, R Choudhury, et al.
Journal of the Royal Society, Interface
|
September 27, 2013
Density-functional theory study of gramicidin A ion channel geometry and electronic properties
Milica Todorović, David R Bowler, Michael J Gillan, et al.
Journal of Chemical Theory and Computation
|
July 18, 2017
Efficient Calculation of Electronic Structure Using O(N) Density Functional Theory
Ayako Nakata, Yasunori Futamura, Tetsuya Sakurai, et al.
Journal of Chemical Theory and Computation
|
November 27, 2015
Non-self-consistent Density-Functional Theory Exchange-Correlation Forces for GGA Functionals
Antonio S Torralba, David R Bowler, Tsuyoshi Miyazaki, et al.
The Review of Scientific Instruments
|
April 6, 2013
Arbitrary waveform generator for quantum information processing with trapped ions
R Bowler, U Warring, J W Britton, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 5, 2018
Structural properties of silicon-germanium and germanium-silicon core-shell nanowires
Conn O'Rourke, Shereif Y Mujahed, Chathurangi Kumarasinghe, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
June 22, 2011
Correlated electron-ion dynamics with open boundaries: formalism
D R Bowler, Andrew P Horsfield, Cristián G Sánchez, et al.
Angewandte Chemie (International Ed. in English)
|
February 16, 2010
DNA analysis by dynamic chemistry
Frank R Bowler, Juan J Diaz-Mochon, Michael D Swift, et al.
Journal of Computational Chemistry
|
June 27, 2020
Blue moon ensemble simulation of aquation free energy profiles applied to mono and bifunctional platinum anticancer drugs
Teruo Hirakawa, David R Bowler, Tsuyoshi Miyazaki, et al.
Physical Review Letters
|
January 15, 2021
Insight into the Charge Density Wave Gap from Contrast Inversion in Topographic STM Images
M Spera, A Scarfato, Á Pásztor, et al.
Page
of 11