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The Journal of Chemical Physics
|
February 6, 2008
Excitation energies in density functional theory: an evaluation and a diagnostic test
Michael J G Peach, Peter Benfield, Trygve Helgaker, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 17, 2022
Artificial synthesis of covalent triazine frameworks for local structure and property determination
Catherine Mollart, Sarah Holcroft, Michael J G Peach, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Fractional Electron Loss in Approximate DFT and Hartree-Fock Theory
Michael J G Peach, Andrew M Teale, Trygve Helgaker, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2025
Combining double-hybrid functionals with rSCAN yields solid-state <sup>13</sup>C chemical shifts with sub-ppm accuracy
Harry Brough, Chris W Cook, John M Griffin, et al.
Chemical Communications (Cambridge, England)
|
August 31, 2012
A new water···Na+ coordination motif in an unexpected diatrizoic acid disodium salt crystal form
Katharina Fucke, Michael J G Peach, Judith A K Howard, et al.
The Journal of Physical Chemistry. A
|
June 10, 2010
Shielding constants and chemical shifts in DFT: influence of optimized effective potential and Coulomb-attenuation
Michael J G Peach, John A Kattirtzi, Andrew M Teale, et al.
Magnetic Resonance in Chemistry : MRC
|
November 20, 2018
Investigation of structure and dynamics in a photochromic molecular crystal by NMR crystallography
Benjamin L Dale, Nathan R Halcovitch, Michael J G Peach, et al.
The Journal of Chemical Physics
|
August 22, 2008
Adiabatic connection forms in density functional theory: H2 and the He isoelectronic series
Michael J G Peach, Adam M Miller, Andrew M Teale, et al.
Diabetologia
|
January 17, 2012
Measures of health-related quality of life in diabetes-related foot disease: a systematic review
F R A Hogg, G Peach, P Price, et al.
The Journal of Physical Chemistry. A
|
October 30, 2007
Structural and electronic properties of polyacetylene and polyyne from hybrid and Coulomb-attenuated density functionals
Michael J G Peach, Erik I Tellgren, Paweł Sałek, et al.
Page
of 7
Search research articles
Search
Showing results (41-50 of 63) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
February 6, 2008
Excitation energies in density functional theory: an evaluation and a diagnostic test
Michael J G Peach, Peter Benfield, Trygve Helgaker, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 17, 2022
Artificial synthesis of covalent triazine frameworks for local structure and property determination
Catherine Mollart, Sarah Holcroft, Michael J G Peach, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Fractional Electron Loss in Approximate DFT and Hartree-Fock Theory
Michael J G Peach, Andrew M Teale, Trygve Helgaker, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2025
Combining double-hybrid functionals with rSCAN yields solid-state <sup>13</sup>C chemical shifts with sub-ppm accuracy
Harry Brough, Chris W Cook, John M Griffin, et al.
Chemical Communications (Cambridge, England)
|
August 31, 2012
A new water···Na+ coordination motif in an unexpected diatrizoic acid disodium salt crystal form
Katharina Fucke, Michael J G Peach, Judith A K Howard, et al.
The Journal of Physical Chemistry. A
|
June 10, 2010
Shielding constants and chemical shifts in DFT: influence of optimized effective potential and Coulomb-attenuation
Michael J G Peach, John A Kattirtzi, Andrew M Teale, et al.
Magnetic Resonance in Chemistry : MRC
|
November 20, 2018
Investigation of structure and dynamics in a photochromic molecular crystal by NMR crystallography
Benjamin L Dale, Nathan R Halcovitch, Michael J G Peach, et al.
The Journal of Chemical Physics
|
August 22, 2008
Adiabatic connection forms in density functional theory: H2 and the He isoelectronic series
Michael J G Peach, Adam M Miller, Andrew M Teale, et al.
Diabetologia
|
January 17, 2012
Measures of health-related quality of life in diabetes-related foot disease: a systematic review
F R A Hogg, G Peach, P Price, et al.
The Journal of Physical Chemistry. A
|
October 30, 2007
Structural and electronic properties of polyacetylene and polyyne from hybrid and Coulomb-attenuated density functionals
Michael J G Peach, Erik I Tellgren, Paweł Sałek, et al.
Page
of 7