8 research outputs found
General Suggestions and Applications of Quantum Molecular Similarity Measures from ab initio Fitted Electron Densities
- Author
- AC Good
- AJ Mulholland
- AJC Varandas
- AR Miller
- BC Garret
- BI Dunlap
- BI Dunlap
- BW Matthews
- C Parr
- C Tu
- CG Kolvenbach
- CJ Falzone
- DA Liotard
- DA Pierre
- DB Boyd
- EE Hodgkin
- ET Kaiser
- F Manaut
- F Sanz
- G Lendway
- GA Arteca
- GS Hammond
- GSG Beveridge
- H Sambe
- HM Grindley
- J Cioslowski
- J Cioslowski
- J Cioslowski
- J Mestres
- J Mestres
- JA Bentley
- JA Bentley
- JA Neider
- JV Ortiz
- K Ishikawa
- K M眉ller
- K Nagai
- LE Scales
- LY Fan
- M Randic
- MA Johnson
- MA Wolfe
- MJ Frisch
- MJS Dewar
- MM Francl
- N Agmon
- N Agmon
- N Randic
- N Trinajstic
- PC Hariharan
- PG Mezey
- PG Mezey
- PG Mezey
- PG Mezey
- PG Mezey
- PJ Hay
- PJ Hay
- R Carb贸
- R Carb贸
- R Carb贸
- R Carb贸
- R Carb贸
- R Carb贸
- R Fletcher
- R Franke
- R Ponec
- R Ponec
- R Ponec
- RP Sheridan
- SJ Formosinho
- SJ Formosinho
- SJ Gardell
- SK Gray
- WG Richards
- WJ Hehre
- WJ Hehre
- WR Wadt
- Z Mihalic
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- 01/01/1995
- Field of study
No full textAb initio Studies of Reaction Paths in Excited-State Hydrogen-Transfer Processes
- Author
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- B Dick
- BO Roos
- C Woywod
- CA Mead
- CA Mead
- CA Mead
- D Heidrich
- EM Kosower
- FT Smith
- G Herzberg
- H K枚ppel
- H Tanaka
- H Vranken
- HB Schlegel
- HC Longuet-Higgins
- IB Bersuker
- J Calatan
- J Catalan
- J Heldt
- J Michl
- J Smets
- J Waluk
- K Andersson
- K Andersson
- K Fukui
- KL Kunze
- L Lapinski
- L Lapinski
- L Lapinski
- L Lapinski
- L Salem
- M Dreyfus
- M Kasha
- M Kasha Festschrift
- M Moreno
- M Szczesniak
- MJ Nowak
- MJ Nowak
- MJ Nowak
- MJ Nowak
- MJ Nowak
- MJ Scanlan
- NP Ernsting
- P-T Chou
- PF Barbara
- PG Mezey
- R Rossetti
- RD Brown
- S Kato
- S Nagaoka
- S Nagaoka
- S Nagaoka
- SJ Formosinho
- T Carrington
- T Carrington
- T Pacher
- V Barone
- W Domcke
- W Orttung
- WH Miller
- WH Miller
- X Duan
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- 01/01/1995
- Field of study
No full textNickel Bipyridine (Ni(bpy)3Cl2) Complex Used as Molecular Catalyst for Photocatalytic CO2 Reduction
- Author
- A Nakada
- AJ Morris
- AM Appel
- Biao Qin
- BM Rosen
- C Avelino
- C Cometto
- C Ruiz-P茅rez
- CA Craig
- CD Windle
- D Hong
- D Sahoo
- E Kimura
- EE Barton
- EE Benson
- F Etsuko
- F Wen
- G Neri
- H Fei
- H Rao
- H Tong
- I Yasuo
- J Lin
- J Lin
- J Ran
- J Schneider
- JD Froehlich
- Jinliang Lin
- JM Smieja
- K Maeda
- K Maeda
- K Mochizuki
- K Muraoka
- KN Wong
- M Halmann
- M He
- MF Finlayson
- MF Kuehnel
- P Gao
- PG Alsabeh
- R Kuriki
- R Kuriki
- R Kuriki
- S Sakaki
- S Sato
- S Wang
- S Wang
- S Wiese
- SJ Formosinho
- T Fogeron
- VS Thoi
- W Zhao
- Y Lee
- Y Xie
- Y Yuan
- Z Chai
- Zhenxing Fang
- ZN Al-Qudsi
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textTheoretical study on excited-state intermolecular proton transfer reactions of 1H-pyrrolo[3,2-h]quinoline with water and methanol
- Author
- A Fern谩ndez-Ramos
- A Filarowski
- A Filarowski
- A Gorski
- A Hara
- A Jezierska-Mazzarello
- A Kyrychenko
- A Kyrychenko
- A Kyrychenko
- A Kyrychenko
- A Sch盲fer
- C H盲ttig
- C H盲ttig
- CA Taylor
- D Kina
- D Reyman
- F Weigend
- F Weigend
- G Wiosna
- G-J Zhao
- J Herbich
- J Waluk
- K Sakota
- K Sakota
- K Sakota
- LG Arnaut
- M Barbatti
- M Barbatti
- M Barbatti
- M Barbatti
- M Guglielmi
- M Lawrenz
- Mario Barbatti
- MG Ferlin
- MJS Dewar
- MS Gordon
- N Al-Lawatia
- N Kungwan
- Nawee Kungwan
- NOC Winter
- P Ilich
- R Ahlrichs
- R Daengngern
- R Daengngern
- Rathawat Daengngern
- S Mente
- SJ Formosinho
- Supa Hannongbua
- SY Park
- Tammarat Piansawan
- WC Swope
- Y Nosenko
- Y Nosenko
- Y Nosenko
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textAB Initio Reaction Paths and Potential-Energy Functions for Excited-State Intra- and Intermolecular Hydrogen-Transfer Processes
- Author
- A Douhal
- A Douhal
- A Syntik
- A Sytnik
- A Vodvin
- A Weller
- A Weller
- AJ Wurzer
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- B Menucci
- BA Barry
- BJ Schwartz
- BO Roos
- C Chudoba
- C Janzen
- CJ Seliskar
- CJ Seliskar
- D Creed
- D Gourrierec Le
- D Sundholm
- DKW Mok
- DV Bent
- EKU Gross
- F Lahmani
- F Lahmani
- G Gregoire
- G Pino
- GD Gillespie
- H Watanabe
- H-J Werner
- HB Schlegel
- HJ Heller
- J Keck
- J-EA Otterstedt
- JA Syage
- JB Foresman
- JJ Paz
- JR Merill
- K Andersson
- K Fukui
- K Kleinermanns
- K Luth
- KH Grellmann
- L Arnaut
- LA Helmbrook
- M Fores
- M Gerhards
- M Sch眉tz
- M Sch眉tz
- M Sodupe
- M Yi
- MJ Frisch
- N Mikami
- N Shida
- NC Handy
- O Sinanoglu
- P Chou
- P Hobza
- P Turner
- PB Bisht
- PG Mezey
- PM Felker
- PY Ayala
- RG Parr
- S Ameer-Beg
- S Ishiuchi
- S Nagaoka
- S Re
- S Scheiner
- SJ Formosinho
- SL Baughcum
- SL Baughcum
- SM Ormson
- T Helgaker
- TS Zwier
- V Barone
- W Frey
- W Siebrand
- W Siebrand
- W-H Fang
- W-H Fang
- WF Rowe
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- 01/01/2002
- Field of study
No full textQuasiclassical Methods
- Author
- A Amrein
- A B谩r谩ny
- A Campargue
- A Campargue
- A Campargue
- A Sobolewski
- A Warshel
- A Warshel
- A Warshel
- AA Radzig
- AF Ferguson
- AI Voronin
- AL Sobolewski
- AM Smith
- AM Smith
- B Timm
- BA Waite
- C Chackerian Jr
- C Chackerian Jr.
- C Kormann
- C Zener
- CA Coulson
- CE Brion
- CI Manzanares
- CI Manzanares
- CKN Patel
- D Farrelly
- DA Chernoff
- DC McKean
- DJ Swanton
- ECG Stueckelberg
- EE Nikitin
- EJ Heller
- EN Bodunov
- ES Medvedev
- ES Medvedev
- ES Medvedev
- ES Medvedev
- ES Medvedev
- ES Medvedev
- ES Medvedev
- ES Medvedev
- G Longhi
- G Rimpel
- GA Voth
- GA West
- GJ Scherer
- GO Brink
- HB Levene
- HL Fang
- HL Fang
- HL Fang
- HR D眉bai
- HR D眉bai
- I Madzgalla
- IH K眉hn
- IS Averbukh
- J Gelfand
- J Heading
- J Segall
- JE Baggott
- JE Baggott
- JE Baggott
- JK Hwang
- JM Jasinski
- JM Jasinski
- JR Stine
- JS Hutchinson
- JS Wong
- JW Perry
- JW Perry
- K Cashion
- K Scholz
- KF Freed
- KK Lehmann
- KK Lehmann
- KK Pukhov
- KM Gough
- KV Reddy
- KV Reddy
- LA Kuznetsova
- LA Young
- LC Baylor
- LJ Butler
- LM Biberman
- M Lewerenz
- M Matsuzawa
- MA Lavrentev
- MJ Davis
- MK Ahmed
- ML Koszykowski
- MS Burberry
- MS Burberry
- MS Burberry
- MS Child
- MV Fedoryuk
- MW Crofton
- N Shimakura
- N Yamamoto
- NS Strokach
- OS Mortensen
- OV Balagura
- P Bernage
- P Niay
- P Pechucas
- PC Goswami
- R Feynman
- R Kubo
- R Mecke
- R Nakagaki
- RA Bernheim
- RA Bernheim
- RA Toth
- RD Coalson
- RE Meredith
- RE Meredith
- RH Tipping
- RL Spellicy
- RL Swofford
- RM Badger
- RN Sileo
- SJ Formosinho
- SK Gray
- SL Coy
- SM Melikova
- SP Karkach
- T Uzer
- TA Holme
- VB Nagaev
- VI Krassovsky
- VI Osherov
- VI Osherov
- VI Osherov
- VI Osherov
- VK Bykhovski沫
- VS Vasan
- WS Benedict
- Y Kajanuma
- Y Mikami
- Y Mikami
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- 01/01/1995
- Field of study
No full text
