A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_URI::$config is deprecated
Filename: core/URI.php
Line Number: 101
Backtrace:
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Router::$uri is deprecated
Filename: core/Router.php
Line Number: 127
Backtrace:
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$benchmark is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$hooks is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$config is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$log is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$utf8 is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$uri is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$exceptions is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$router is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$output is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$security is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$input is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$lang is deprecated
Filename: core/Controller.php
Line Number: 75
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$load is deprecated
Filename: core/Controller.php
Line Number: 78
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: "continue" targeting switch is equivalent to "break". Did you mean to use "continue 2"?
Filename: helpers/ben_helper.php
Line Number: 302
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Optional parameter $author_name declared before required parameter $filename is implicitly treated as a required parameter
Filename: helpers/ben_helper.php
Line Number: 841
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$db is deprecated
Filename: core/Loader.php
Line Number: 390
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_DB_mysqli_driver::$failover is deprecated
Filename: database/DB_driver.php
Line Number: 371
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$pagination is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$agent is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$zip is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Optional parameter $options declared before required parameter $closed is implicitly treated as a required parameter
Filename: models/Poll_model.php
Line Number: 191
Backtrace:
File: /home/scotchem/public_html/talks/application/libraries/Poll_lib.php
Line: 25
Function: model
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$poll_model is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/libraries/Poll_lib.php
Line: 25
Function: model
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$poll_lib is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$encryption is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$xmlrpc is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$form_validation is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$email is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$upload is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$paypal is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::open($save_path, $name) should either be compatible with SessionHandlerInterface::open(string $path, string $name): bool, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 129
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::close() should either be compatible with SessionHandlerInterface::close(): bool, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 278
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::read($session_id) should either be compatible with SessionHandlerInterface::read(string $id): string|false, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 149
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::write($session_id, $session_data) should either be compatible with SessionHandlerInterface::write(string $id, string $data): bool, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 206
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::destroy($session_id) should either be compatible with SessionHandlerInterface::destroy(string $id): bool, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 295
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Return type of CI_Session_database_driver::gc($maxlifetime) should either be compatible with SessionHandlerInterface::gc(int $max_lifetime): int|false, or the #[\ReturnTypeWillChange] attribute should be used to temporarily suppress the notice
Filename: drivers/Session_database_driver.php
Line Number: 333
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 284
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: session_set_cookie_params(): Session cookie parameters cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 291
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 306
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 316
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 317
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 318
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 319
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: ini_set(): Session ini settings cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 377
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: session_set_save_handler(): Session save handler cannot be changed after headers have already been sent
Filename: Session/Session.php
Line Number: 110
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: Warning
Message: session_start(): Session cannot be started after headers have already been sent
Filename: Session/Session.php
Line Number: 143
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$session is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$email_model is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$pagination_model is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$image_lib is deprecated
Filename: core/Loader.php
Line Number: 1279
Backtrace:
File: /home/scotchem/public_html/talks/application/models/Crud_model.php
Line: 13
Function: library
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Crud_model::$account_type is deprecated
Filename: models/Crud_model.php
Line Number: 15
Backtrace:
File: /home/scotchem/public_html/talks/application/models/Crud_model.php
Line: 15
Function: _error_handler
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$crud_model is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$sms_model is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 15
Function: __construct
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$dbutil is deprecated
Filename: core/Loader.php
Line Number: 425
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 16
Function: dbutil
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property Talks::$backup is deprecated
Filename: core/Loader.php
Line Number: 353
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 21
Function: model
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$benchmark is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$hooks is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$config is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$log is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$utf8 is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$uri is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$exceptions is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
File: /home/scotchem/public_html/talks/application/controllers/Talks.php
Line: 397
Function: view
File: /home/scotchem/public_html/talks/index.php
Line: 268
Function: require_once
A PHP Error was encountered
Severity: 8192
Message: Creation of dynamic property CI_Loader::$router is deprecated
Filename: core/Loader.php
Line Number: 925
Backtrace:
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Talk detail - Using ab initio approaches to model, predict and understand the optical properties of organic and inorganic dyes - Joint Chemistry/Physics Colloquium |
ScotCHEM Colloquia
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Using ab initio approaches to model, predict and understand the optical properties of organic and inorganic dyes - Joint Chemistry/Physics Colloquium
Main list: St Andrews
Abstract
Using ab initio approaches to model, predict and understand the optical properties of organic and inorganic dyes Denis Jacquemin Laboratoire CEISAM, UMR CNRS n°6230, Université de Nantes, 2, rue de la Houssinière, 44322 Nantes, Cedex 3, France. Denis.Jacquemin@univ -nantes.fr During this lecture, I will illustrate some of the successes and failures of Time-Dependent Density Functional Theory (TD -DFT) in simulating the properties of electronically excited -states, with a specific interest on structures of interest for dye chemistry. 1-2 Notably, I will discuss the importance of calculating vibronic effects to obtain accurate comparisons with experimental data, including 0 -0 energies and band shapes, and illustrate this aspect with several examples. 3 I will also present examples of applications of TD -DFT to real-life structures used in LEDs focussing on two examples: ESIPT -based organic dyes for white OLEDs 4 and inorganic complexes used in blue/green/red phosphors. 5 1 D. Jacquemin, C. Adamo, Chem. Soc. Rev., 2013, 42, 845 . 2 D. Jacquemin, C. Adamo, Top. Curr. Chem.. , 2016 , 368 , 345 . 3 F. Santoro, D. Jacquemin, Wires. Comput. Mol. Sci. 2016, 6, 460. 4 A. Steffen, K. Costuas, A. Bouccekkine, M. H. Thibault, A. Beeby, A. S. Batsanov, D. Jacquemin, A. Charaf -Eddin, J. F. Halet, T. D. Marder Inorg. Chem. , 2014 , 53 , 7055 . 5 E. Heyer, K. Benelhadj, S. Budzak, D. Jacquemin, J. Massue, G. Ulrich Chem. Eur. J ., 2017, 23, 7324 . 6 D W . Zhang, D. Jacquemin, Q. Peng, Z. Suhai, D. Escudero, J. Phys. Chem. C, 2018 , 122 , 6340 .
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