Search research articles
Contact Us
Filters
Showing results (21-30 of 66) with videos related to
Page
of 7
Sort By:
The Journal of Chemical Physics
|
September 17, 2016
Basis set convergence of CCSD(T) equilibrium geometries using a large and diverse set of molecular structures
Peter R Spackman, Dylan Jayatilaka, Amir Karton
Scientific Reports
|
February 25, 2016
High Throughput Profiling of Molecular Shapes in Crystals
Peter R Spackman, Sajesh P Thomas, Dylan Jayatilaka
Acta Crystallographica. Section A, Foundations and Advances
|
January 5, 2021
HgH<sub>2</sub> meets relativistic quantum crystallography. How to teach relativity to a non-relativistic wavefunction
Michal Podhorský, Lukáš Bučinský, Dylan Jayatilaka, et al.
The Journal of Chemical Physics
|
November 15, 2006
Effective molecular polarizabilities and crystal refractive indices estimated from x-ray diffraction data
Andrew E Whitten, Dylan Jayatilaka, Mark A Spackman
Biophysical Journal
|
May 16, 2006
Determination of the orientational distribution and orientation factor for transfer between membrane-bound fluorophores using a confocal microscope
Ben Corry, Dylan Jayatilaka, Boris Martinac, et al.
Chemical Communications (Cambridge, England)
|
January 26, 2008
Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces
Joshua J McKinnon, Dylan Jayatilaka, Mark A Spackman
Acta Crystallographica. Section A, Foundations of Crystallography
|
February 16, 2007
Are intramolecular dynamic electron correlation effects detectable in X-ray diffraction experiments on molecular crystals?
Ian Bytheway, Graham Chandler, Brian Figgis, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 2, 2010
The electron localizability indicator from X-ray diffraction data--a first application to a series of epoxide derivatives
Simon Grabowsky, Dylan Jayatilaka, Stefan Mebs, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2015
S···O chalcogen bonding in sulfa drugs: insights from multipole charge density and X-ray wavefunction of acetazolamide
Sajesh P Thomas, Dylan Jayatilaka, T N Guru Row
Iucrj
|
September 19, 2018
Bond orders for intermolecular interactions in crystals: charge transfer, ionicity and the effect on intramolecular bonds
Khidhir Alhameedi, Amir Karton, Dylan Jayatilaka, et al.
Page
of 7
Search research articles
Search
Showing results (21-30 of 66) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
September 17, 2016
Basis set convergence of CCSD(T) equilibrium geometries using a large and diverse set of molecular structures
Peter R Spackman, Dylan Jayatilaka, Amir Karton
Scientific Reports
|
February 25, 2016
High Throughput Profiling of Molecular Shapes in Crystals
Peter R Spackman, Sajesh P Thomas, Dylan Jayatilaka
Acta Crystallographica. Section A, Foundations and Advances
|
January 5, 2021
HgH<sub>2</sub> meets relativistic quantum crystallography. How to teach relativity to a non-relativistic wavefunction
Michal Podhorský, Lukáš Bučinský, Dylan Jayatilaka, et al.
The Journal of Chemical Physics
|
November 15, 2006
Effective molecular polarizabilities and crystal refractive indices estimated from x-ray diffraction data
Andrew E Whitten, Dylan Jayatilaka, Mark A Spackman
Biophysical Journal
|
May 16, 2006
Determination of the orientational distribution and orientation factor for transfer between membrane-bound fluorophores using a confocal microscope
Ben Corry, Dylan Jayatilaka, Boris Martinac, et al.
Chemical Communications (Cambridge, England)
|
January 26, 2008
Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces
Joshua J McKinnon, Dylan Jayatilaka, Mark A Spackman
Acta Crystallographica. Section A, Foundations of Crystallography
|
February 16, 2007
Are intramolecular dynamic electron correlation effects detectable in X-ray diffraction experiments on molecular crystals?
Ian Bytheway, Graham Chandler, Brian Figgis, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 2, 2010
The electron localizability indicator from X-ray diffraction data--a first application to a series of epoxide derivatives
Simon Grabowsky, Dylan Jayatilaka, Stefan Mebs, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2015
S···O chalcogen bonding in sulfa drugs: insights from multipole charge density and X-ray wavefunction of acetazolamide
Sajesh P Thomas, Dylan Jayatilaka, T N Guru Row
Iucrj
|
September 19, 2018
Bond orders for intermolecular interactions in crystals: charge transfer, ionicity and the effect on intramolecular bonds
Khidhir Alhameedi, Amir Karton, Dylan Jayatilaka, et al.
Page
of 7