Jove
Visualize
Contact Us
JoVE
x logofacebook logolinkedin logoyoutube logo
ABOUT JoVE
OverviewLeadershipBlogJoVE Help Center
AUTHORS
Publishing ProcessEditorial BoardScope & PoliciesPeer ReviewFAQSubmit
LIBRARIANS
TestimonialsSubscriptionsAccessResourcesLibrary Advisory BoardFAQ
RESEARCH
JoVE JournalMethods CollectionsJoVE Encyclopedia of ExperimentsArchive
EDUCATION
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab ManualFaculty Resource CenterFaculty Site
Terms & Conditions of Use
Privacy Policy
Policies

Filters

Frank De Proft

Showing results (91-100 of 211) with videos related to

Pageof 22
Sort By:
Physical Chemistry Chemical Physics : PCCP|December 12, 2023
Wandering through quantum-mechanochemistry: from concepts to reactivity and switchesMercedes Alonso, Tom Bettens, Jochen Eeckhoudt, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|June 10, 2020
Alkaline Earth Metals Activate N<sub>2</sub> and CO in Cubic Complexes Just Like Transition Metals: A Conceptual Density Functional Theory and Energy Decomposition Analysis StudyTom Bettens, Sudip Pan, Frank De Proft, et al.
Molecules (Basel, Switzerland)|June 6, 2018
Aromaticity as a Guiding Concept for Spectroscopic Features and Nonlinear Optical Properties of PorphyrinoidsTatiana Woller, Paul Geerlings, Frank De Proft, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|September 1, 2007
Can electrophilicity act as a measure of the redox potential of first-row transition metal ions?Jan Moens, Goedele Roos, Pablo Jaque, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|August 2, 2008
Do the local softness and hardness indicate the softest and hardest regions of a molecule?Miquel Torrent-Sucarrat, Frank De Proft, Paul Geerlings, et al.
The Journal of Physical Chemistry. A|November 4, 2008
Intrinsic nucleofugality scale within the framework of density functional reactivity theoryLies Broeckaert, Jan Moens, Goedele Roos, et al.
Inorganic Chemistry|May 2, 2023
Mechanistic Study and Conceptual Chemical Reactivity Analysis of Hydroboration of Carbon Dioxide Catalyzed by a Manganese(I)-PNP-Pincer ComplexBin Wang, Chunying Rong, Ming Lei, et al.
The Journal of Physical Chemistry. A|April 14, 2006
Study of molecular quantum similarity of enantiomers of amino acidsGreet Boon, Christian Van Alsenoy, Frank De Proft, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|November 9, 2017
Conceptual Insights into DFT Spin-State Energetics of Octahedral Transition-Metal Complexes through a Density Difference AnalysisBalazs Pinter, Artiom Chankisjijev, Paul Geerlings, et al.
Journal of Computational Chemistry|November 11, 2017
Characterization of chalcogen bonding interactions via an in-depth conceptual quantum chemical analysisFreija De Vleeschouwer, Mats Denayer, Balazs Pinter, et al.
Pageof 22

Showing results (91-100 of 211) with videos related to

Sort By:
Pageof 22
Physical Chemistry Chemical Physics : PCCP|December 12, 2023
Wandering through quantum-mechanochemistry: from concepts to reactivity and switchesMercedes Alonso, Tom Bettens, Jochen Eeckhoudt, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|June 10, 2020
Alkaline Earth Metals Activate N<sub>2</sub> and CO in Cubic Complexes Just Like Transition Metals: A Conceptual Density Functional Theory and Energy Decomposition Analysis StudyTom Bettens, Sudip Pan, Frank De Proft, et al.
Molecules (Basel, Switzerland)|June 6, 2018
Aromaticity as a Guiding Concept for Spectroscopic Features and Nonlinear Optical Properties of PorphyrinoidsTatiana Woller, Paul Geerlings, Frank De Proft, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|September 1, 2007
Can electrophilicity act as a measure of the redox potential of first-row transition metal ions?Jan Moens, Goedele Roos, Pablo Jaque, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|August 2, 2008
Do the local softness and hardness indicate the softest and hardest regions of a molecule?Miquel Torrent-Sucarrat, Frank De Proft, Paul Geerlings, et al.
The Journal of Physical Chemistry. A|November 4, 2008
Intrinsic nucleofugality scale within the framework of density functional reactivity theoryLies Broeckaert, Jan Moens, Goedele Roos, et al.
Inorganic Chemistry|May 2, 2023
Mechanistic Study and Conceptual Chemical Reactivity Analysis of Hydroboration of Carbon Dioxide Catalyzed by a Manganese(I)-PNP-Pincer ComplexBin Wang, Chunying Rong, Ming Lei, et al.
The Journal of Physical Chemistry. A|April 14, 2006
Study of molecular quantum similarity of enantiomers of amino acidsGreet Boon, Christian Van Alsenoy, Frank De Proft, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|November 9, 2017
Conceptual Insights into DFT Spin-State Energetics of Octahedral Transition-Metal Complexes through a Density Difference AnalysisBalazs Pinter, Artiom Chankisjijev, Paul Geerlings, et al.
Journal of Computational Chemistry|November 11, 2017
Characterization of chalcogen bonding interactions via an in-depth conceptual quantum chemical analysisFreija De Vleeschouwer, Mats Denayer, Balazs Pinter, et al.
Pageof 22