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 Neese

Showing results (31-40 of 559) with videos related to

Pageof 56
Sort By:
Chemical Society Reviews|March 29, 2014
Chemical applications carried out by local pair natural orbital based coupled-cluster methodsManuel Sparta, Frank Neese
The Journal of Chemical Physics|March 17, 2019
Spin-dependent properties in the framework of the dynamic correlation dressed complete active space methodLucas Lang, Frank Neese
The Journal of Physical Chemistry. A|March 21, 2013
Excited states of large open-shell molecules: an efficient, general, and spin-adapted approach based on a restricted open-shell ground state wave functionMichael Roemelt, Frank Neese
The Journal of Chemical Physics|November 6, 2007
Analysis and prediction of absorption band shapes, fluorescence band shapes, resonance Raman intensities, and excitation profiles using the time-dependent theory of electronic spectroscopyTaras Petrenko, Frank Neese
The Journal of Chemical Physics|August 17, 2011
The relationship between double excitation amplitudes and Z vector components in some post-Hartree-Fock correlation methodsChristian Kollmar, Frank Neese
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 3, 2010
Substrate binding and activation in the active site of cytochrome c nitrite reductase: a density functional studyDmytro Bykov, Frank Neese
The Journal of Physical Chemistry. A|November 3, 2006
Spin-spin contributions to the zero-field splitting tensor in organic triplets, carbenes and biradicals-a density functional and ab initio studySebastian Sinnecker, Frank Neese
The Journal of Chemical Physics|January 25, 2013
An efficient and near linear scaling pair natural orbital based local coupled cluster methodChristoph Riplinger, Frank Neese
Journal of the American Chemical Society|March 4, 2010
The unusual electronic structure of dinitrosyl iron complexesShengfa Ye, Frank Neese
Physical Chemistry Chemical Physics : PCCP|April 1, 2015
Theoretical chemistry developments: from electronic structure to simulationsBarbara Kirchner, Frank Neese
Pageof 56

Showing results (31-40 of 559) with videos related to

Sort By:
Pageof 56
Chemical Society Reviews|March 29, 2014
Chemical applications carried out by local pair natural orbital based coupled-cluster methodsManuel Sparta, Frank Neese
The Journal of Chemical Physics|March 17, 2019
Spin-dependent properties in the framework of the dynamic correlation dressed complete active space methodLucas Lang, Frank Neese
The Journal of Physical Chemistry. A|March 21, 2013
Excited states of large open-shell molecules: an efficient, general, and spin-adapted approach based on a restricted open-shell ground state wave functionMichael Roemelt, Frank Neese
The Journal of Chemical Physics|November 6, 2007
Analysis and prediction of absorption band shapes, fluorescence band shapes, resonance Raman intensities, and excitation profiles using the time-dependent theory of electronic spectroscopyTaras Petrenko, Frank Neese
The Journal of Chemical Physics|August 17, 2011
The relationship between double excitation amplitudes and Z vector components in some post-Hartree-Fock correlation methodsChristian Kollmar, Frank Neese
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 3, 2010
Substrate binding and activation in the active site of cytochrome c nitrite reductase: a density functional studyDmytro Bykov, Frank Neese
The Journal of Physical Chemistry. A|November 3, 2006
Spin-spin contributions to the zero-field splitting tensor in organic triplets, carbenes and biradicals-a density functional and ab initio studySebastian Sinnecker, Frank Neese
The Journal of Chemical Physics|January 25, 2013
An efficient and near linear scaling pair natural orbital based local coupled cluster methodChristoph Riplinger, Frank Neese
Journal of the American Chemical Society|March 4, 2010
The unusual electronic structure of dinitrosyl iron complexesShengfa Ye, Frank Neese
Physical Chemistry Chemical Physics : PCCP|April 1, 2015
Theoretical chemistry developments: from electronic structure to simulationsBarbara Kirchner, Frank Neese
Pageof 56