10 research outputs found
Hydrogen Adsorption on Small Zeolite-Supported Rhodium Clusters. A Density Functional Study
- Author
- Atkins P. W.
- Baerlocher C.
- Blöchl P. E.
- Dinda S.
- Georgi N. Vayssilov
- Guzman J.
- Hayek K.
- Ivanova Shor E. A.
- Ivanova Shor E. A.
- Kip B. J.
- Kresse G.
- Kresse G.
- Kresse G.
- Notker Rösch
- Oudenhuijzen M. K.
- Perdew J. P.
- Petkov P.
- Petrova G. P.
- Petrova G. P.
- Petrova G. P.
- Sachtler W. M. H.
- Serna P.
- Serna P.
- Shor A. M.
- Sierka M.
- Tang W.
- Vajda S.
- Vayssilov G. N.
- Vayssilov G. N.
- Vayssilov G. N.
- Velina K. Markova
- Weber W. A.
- Publication venue
- 'American Chemical Society (ACS)'
- Publication date
- Field of study
No full textConfined But-2-ene Catalytic Isomerization Inside H-ZSM-5 Models: A DFT Study
- Author
- Back M. H.
- Back M. H.
- Baerlocher C.
- Barone G.
- Becke A. D.
- Benson S. W.
- Binkley J. S.
- Boronat M.
- Boronat M.
- Bowker M.
- Boys S. F.
- BrÀndle M.
- Clark A. E.
- Conner W. C.
- Corma A.
- Corma A.
- Cramer C. J.
- Cundall R. B.
- Cundall R. B.
- Damin A.
- de MĂ©norval B.
- Delbecq F.
- Demuth T.
- Egger K. W.
- Francl M. M.
- Frisch M. J.
- Gleeson D.
- Golden D. M.
- Gordon M. S.
- Graefenstein J.
- Hariharan P. C.
- Hay P. J.
- Ivanov P.
- Ivanova Shor E. A.
- Ivanova Shor E. A.
- Jansang B.
- Kazansky V. B.
- Kazansky V. B.
- Kubicka D.
- Milas I.
- Milas I.
- Miyamoto A.
- Moc J.
- Nieminen V.
- Nkosi B.
- Peng C.
- Raghavachari K.
- Rozanska X. X.
- Sauer J.
- Sauer J.
- Schreiner P. R.
- Schreiner P. R.
- Solans-Monfort X.
- Sommer J.
- Stephens P. J.
- Stratmann R. E.
- Tao Y.
- Teunissen E. H.
- Teunissen E. H.
- Tirado-Rives J.
- Truitt M. J.
- Tuma C.
- van Santen R. A.
- van Santen R. A.
- Vayssilov G. N.
- Wang H.
- Wang X.
- Wei J.
- Xu T.
- Yoda E.
- Publication venue
- 'American Chemical Society (ACS)'
- Publication date
- Field of study
No full textThe cumulative coordinate method for describing the electrostatic potential and field in silica zeolite polymorphs
- Author
- A. J. Stone
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. V. Larin
- A. Volkov
- C. E. Whitehead
- C. Gatti
- C. M. Zicovich-Wilson
- C. Pisani
- D. N. Trubnikov
- D. P. Vercauteren
- D. S. Kosov
- E. A. Ivanova-Shor
- G. Maroulis
- J. C. White
- J. C. White
- J. Sauer
- L. Joubert
- N. Ferre
- P. Kedzierski
- P. Ugliengo
- R. Dovesi
- R. Rein
- S. M. Bass
- S. Savitz
- V. R. Saunders
- V. R. Saunders
- V. R. Saunders
- W. A. Sokalski
- X. Rozanska
- X. Rozanska
- Publication venue
- 'Pleiades Publishing Ltd'
- Publication date
- Field of study
No full textInvestigation of Reverse-Hydrogen Spillover on Zeolite-Supported Palladium Tetramer by ONIOM Method
- Author
- Alexeev O.
- Baerlocher C.
- Bai X.
- Barthomeuf D.
- Becke A. D.
- Bertani V.
- Beutel T.
- Bussai C.
- Catlow C. R. A.
- Ciebien J. F.
- Colligan M.
- Dapprich S.
- Ehresmann J. O.
- Eichler U.
- Frisch M. J.
- Gates B. C.
- Gomes J. R. B.
- Harmsen R.
- Hartmann M.
- Hay P. J.
- Hay P. J.
- Henson N. J.
- Hriljac J. A.
- Ivanova Shor E. A.
- Ivanova Shor E. A.
- Jiang Y.-X.
- Joshi A. M.
- Joyner R. W.
- Kasuriya S.
- Kim J. G.
- Lee C.
- Löwenstein W.
- Matsumoto H.
- McCarthy T. J.
- Meier W. M.
- Mikhailov M. N.
- Mikhailov M. N.
- Moc J.
- Moc J.
- Moller K.
- Moller K.
- Nakano T.
- Nasluzov V. A.
- Nasluzov V. A.
- Neyman K. M.
- Okumura K.
- Petrova G. P.
- Petrova G. P.
- Rappe A. K.
- Ryoo R.
- Sachtler W. M. H.
- Sachtler W. M. H.
- Slovetskaya K. I.
- Sordelli L.
- Stakheev A. Yu.
- Stakheev A. Yu.
- Stephens P. J.
- Tanabe S.
- Vayssilov G. N.
- Vayssilov G. N.
- Vogel W.
- Vosko S. H.
- Yakovlev A. L.
- Yokoyama T.
- Zhang W.
- Zhang Z.
- Zhang Z.
- Zhang Z.
- Publication venue
- 'American Chemical Society (ACS)'
- Publication date
- Field of study
No full textLocal Theory of Bendings of Surfaces
- Author
- A Fogelsanger
- A Legendre
- AB Vasifeva
- AD Aleksandrov
- AD Aleksandrov
- AD Aleksandrov
- AD Aleksandrov
- AD Aleksandrov
- AD Milka
- AD Milka
- AG Dorfman
- AV Bushmelev
- AV Pogorelov
- AV Pogorelov
- AV Pogorelov
- CS Lin
- CS Paris Lin
- DA Trotsenko
- DV Lashchenko
- DV Lashchenko
- E Berger
- E Calabi
- E Kann
- EG Poznyak
- EG Poznyak
- EG Poznyak
- EG Poznyak
- EP Senâkin
- G Bol
- G Darboux
- G Hellwig
- G Nakamura
- H Gluck
- H Gluck
- H Hopf
- H Jacobowitz
- H Jacobowitz
- H Jacobowitz
- H Jacobowitz
- H Lebesgue
- H Lebesgue
- H Schilt
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- I Ivanova-Karatopraklieva
- IG Maksimov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IK Sabitov
- IN Vekua
- IN Vekua
- J Hong
- J Nash
- L Nirenberg
- LA Shor
- LK Sabitov
- M Artin
- M Artin
- M Berger
- M Spivak
- MI Vojtsekhovskij
- MI Vojtsekhovskij
- ML Gromov
- N Kuiper
- N Kuiper
- NN Yanenko
- NN Yanenko
- NS Sinyukov
- NV Efimov
- NV Efimov
- NV Efimov
- NV Efimov
- NV Efimov
- NV Efimov
- P Hartman
- P Hartman
- P Vincensini
- PA Griffiths
- PE Markov
- PE Markov
- R Boudet
- R Bricard
- R Connelly
- R Connelly
- R Connelly
- R Höesli
- R Sauer
- R Sauer
- RA Goldstein
- RD Gulliver
- RY Berri
- SB Klimentov
- SB Klimentov
- SE Cohn-Vossen
- SE Cohn-Vossen
- SS Chern
- TG Isanov
- VA Aleksandrov
- VA Kuznetsov
- VA Tartakovskij
- VA Zalgaller
- VP Belousova
- VT Fomenko
- VT Fomenko
- W Whiteley
- W Whiteley
- W Whiteley
- YD Burago
- YF Borisov
- YG Reshetnyak
- YG Reshetnyak
- ZD Usmanov
- ZT Makarova
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- 01/01/1992
- Field of study
No full textBosutinib plus capecitabine for selected advanced solid tumours: results of a phase 1 dose-escalation study
- Author
- A Beck
- A Calles
- A Ivanova
- A Serrels
- A Vultur
- AC Shor
- AI Daud
- BS Verbeek
- BT Hennessy
- C Le Tourneau
- D Wang
- E Calvo
- E Leip
- E Van Cutsem
- EL Mayer
- F Huang
- FM Johnson
- G Somlo
- GJ Peters
- GV Koukourakis
- H Jallal
- I Ischenko
- J Du
- JE Cortes
- JE Cortes
- JG Trevino
- JH Strickler
- JL Blum
- JL Blum
- JL Blum
- JM Golas
- JM Summy
- K Turnbull
- KV Gleixner
- L Duvillié
- L Gandhi
- LN Puls
- M Amari
- M Campone
- M Campone
- M Guarino
- MS Talamonti
- N Bardy-Bouxin
- P Ceppi
- P Fumoleau
- P Reichardt
- P Therasse
- PG Johnston
- RS Finn
- RS Finn
- S J Isakoff
- S Liu
- S Nam
- SA Rabbani
- SI Park
- SJ Parsons
- TH Cartwright
- WA Messersmith
- Y Song
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textIndigenous minorities of Siberia and Russian sociolinguistics of the 1920s: A life apart?
- Author
- Alkor Ya P.
- Alpatov Vladimir
- Alpatov Vladimir
- Alpatov Vladimir
- Alpatov Vladimir
- Bartels Denis
- Bogoras-Tan V. G.
- Brandist Craig
- Brandist Craig
- Brandist Craig
- Brandist Craig
- Danilov G. K.
- Danilov G. K.
- Eliseeva I.
- Fedorova K.
- Foujeron i.
- Gagen-Torn N. I.
- Gagen-Torn N. I.
- Gernet Katharina
- Grenoble Lenore A.
- Gulida V.
- Ivanova Irina
- Jakubinskiy L. P.
- Kaganovich S. K.
- Kan Sergei
- Kartsevskii Sergei
- Kendall Laurel
- Kochergina V. A.
- Krupnik Igor
- Krupnik Igor
- Krupnik Igor
- Krupnik Igor
- Larin B.
- Larin B.
- LÀhteenmÀki M.
- Mikhailova E.
- Nikolai Vakhtin
- Paulston Christina Bratt
- Peterson M. N.
- Polivanov Ye D.
- Polivanov Ye D.
- Polivanov Ye D.
- Polivanov Ye. D.
- Selischev A. M.
- Shavrov K. V.
- Shor R. O.
- Sirina A. A.
- Spielrein I. N.
- Ssorin-Chaikov N.
- Staniukovich T. V.
- Toporov V. N.
- Trubetskoy N. S.
- Trubetskoy N. S.
- Tucker Robert C.
- Vakhtin N.
- Vakhtin Nikolai
- Vinogradov V. V.
- Voloshinov V. N.
- Publication venue
- 'Informa UK Limited'
- Publication date
- Field of study
No full textPropan-2-ol dehydration on H-ZSM-5 and H-Y zeolite: a DFT study
- Author
- A Damin
- AD Becke
- AlexanderV Larin
- AM Silva
- Amarajothi Dhakshinamoorthy
- Avelino Corma
- C Baerlocher
- C MĂžller
- C Peng
- C Tuma
- CC Lee
- CM Zicovich-Wilson
- D Duca
- D Gleeson
- E Alesso
- EA Ivanova Shor
- EH Teunissen
- EH Teunissen
- Francesco Ferrante
- G Barone
- G Barone
- G Barone
- G Busca
- G Delahay
- G Li Manni
- GN Vayssilov
- H Wang
- I Milas
- J Sommer
- J Tirado-Rives
- JB Foresman
- Kanjarat Sukrat
- Kiminori Sato
- LeonGA Water van de
- M Boronat
- M Boronat
- M Farcasiu
- M Head-Gordon
- MJ Frisch
- MJ Frisch
- MJ Frisch
- MJ Truitt
- MM Francl
- N Armata
- P Borges
- P VĂĄzquez
- PJ Stephens
- RA Santen van
- RichardC Larock
- S Donk van
- S SaebĂž
- SF Boys
- SK Jana
- T Demuth
- Unni Olsbye
- V Nieminen
- V Uffe
- X Wang
- Ying-Xin Sun
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textHâZSM-5 Modified Zeolite:â Quantum Chemical Models of Acidic Sites
- Author
- Alkhawaldeh A.
- Astala R.
- Auroux A.
- Barone G.
- Bates S. P.
- Becke A. D.
- Berlier G.
- Bhering D. L.
- Binkley J. S.
- Bludau H.
- Bordiga S.
- Boronat M.
- Boronat M.
- Boronat M.
- Botes F. G.
- Boys S. F.
- BrÀndle M.
- Chatterjee A.
- Chatterjee A.
- Chen D.
- Corma A.
- Damin A.
- Dario Duca
- Demontis P.
- Dewar M. J. S.
- Duca D.
- Duca D.
- Duca D.
- Duca D.
- Duca D.
- Duca D.
- Dura-Vila V.
- Fagherazzi G.
- Fan Y.
- Farneth W. E.
- Fermann J. T.
- Francl M. M.
- Fyfe C. A.
- Ghandi K.
- Giampaolo Barone
- Girolamo Casella
- Gordon M. S.
- Guisnet M.
- Hariharan P. C.
- Hillier H. I.
- Hunger B.
- Hunt K. L. C.
- Ivanova Shor E. A.
- Jiang Y.-X.
- Jung J. S.
- Kazansky V. B.
- Kucera J.
- Limtrakul J.
- Liu C.
- Lo C.
- Lomratsiri J.
- Long Y.
- Ma D.
- MartĂnez-MagadĂĄn J. M.
- Masears F.
- Maurin G.
- Mignon P.
- Milas I.
- Morales-Pacheco P.
- Mota C. J. A.
- Namuangruk S.
- Neurock M.
- Nieminem V.
- O'Keefe M.
- Okulik N. B.
- Panjan W.
- Pellenq R. J.-M.
- Pires J.
- Raksakoon C.
- Rossini S.
- Rozanska X.
- Sarv P.
- Sauer J.
- Sergio Giuffrida
- Sierka M.
- Sillar K.
- Sillar K.
- Sillar K.
- Smirniotis P. G.
- Spoto G.
- Stephens P. J.
- Tantanak D.
- Tao Y.
- Truitt M. J.
- van Santen R. A.
- Wan Y. S. S.
- Wang H.
- Wang X.
- Xu T.
- Yuan S.
- Yuan S.
- Yuan S. P.
- Zheng X.
- Zheng X.
- Zheng X.
- Zhou D.
- Zhou D.
- Publication venue
- 'American Chemical Society (ACS)'
- Publication date
- Field of study
No full textStructural and Kinetic DFT Characterization of Materials to Rationalize Catalytic Performance
- Author
- A Bandara
- A Corma
- A Corma
- A. Prestianni
- AD Becke
- AD Becke
- AK RappĂš
- AK RappĂš
- AP Scott
- B Minaev
- C Adamo
- C Baerlocher
- C Peng
- C Peng
- C Tuma
- D Curulla
- D Duca
- D Duca
- D Duca
- D Duca
- D Duca
- D Gleeson
- D Kubicka
- D Loffreda
- D. Duca
- DM Golden
- E Ozensoy
- EA Ivanova Shor
- EH Teunissen
- EH Teunissen
- F Masears
- F. Ferrante
- G Barone
- G Barone
- G Pacchioni
- G Valerio
- G. Baldissin
- G. Barone
- G. Li Manni
- GA Somorjai
- GN Vayssilov
- H Markus
- H Markus
- H Markus
- H Markus
- H Markus
- I Efremenko
- I Efremenko
- I StarĂ
- J Rogan
- J Sauer
- J Tirado-Rives
- JA Dumesic
- JB Foresman
- JC Compuzano
- JC Kotz
- JL Robbins
- K Coulter
- K Kobayashi
- KW Egger
- LM Bronstein
- M Boudart
- M Bowker
- M BrÀndle
- M Morkel
- M Neurock
- M Svensson
- MH Back
- MH Back
- MJ Harrison
- MJS Dewar
- MMJ Treacy
- N Semagina
- N. Armata
- PG Hay
- PG Hay
- PJ Stephens
- R. Cortese
- RA Santen van
- RA Santen van
- RB Cundall
- RB Cundall
- S Dapprich
- S Hong
- S. Giuffrida
- SF Boys
- SW Benson
- T Vreven
- T. Rubino
- TH Dunning
- V Bertani
- V Nieminem
- V. DâAnna
- VA Matsura
- VB Kazansky
- WCJ Conner
- X Solans-Monfort
- XX Rozanska
- Y Tao
- Y Wang
- Y Wang
- Y Zhao
- Y Zhao
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full text
