8 research outputs found
Molecular simulation and microtextural characterization of quartz dissolution in sodium hydroxide
- Author
- A Bosak
- A Degen
- A Pelmenschikov
- AC Lasaga
- AF Wallace
- AF White
- AM Ali
- BR Bickmore
- D Vanderbilt
- E Escamilla-Roa
- H Eschrig
- J Aufort
- J Labrid
- J Schott
- J Yang
- JD Rimstidt
- JJ Yang
- MCF Wander
- MJ Nilges
- NA Pertsev
- NY Dzade
- P Zubko
- PJ Pollard
- PM Dove
- PM Dove
- S Bagci
- S Nangia
- S Nangia
- SJ Clark
- SL Brantley
- SL Brantley
- ST Zhang
- SV Yanina
- TPM Goumans
- V Hornof
- X Wang
- Y Xiao
- YQ Qiu
- YW Chen
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textA quantum chemistry evaluation of the stereochemical activity of the lone pair in PbII complexes with sequestering ligands
- Author
- A Person Le
- AE Martell
- AE Reed
- AO Olatunde
- AO Olatunde
- Aurélien Moncomble
- C Adamo
- C Gourlaouen
- C Gourlaouen
- C Morell
- ES Claudio
- F Cuenot
- F Cuenot
- H Ohtaki
- J Tomasi
- Jean-Paul Cornard
- JP Perdew
- JP Perdew
- JW Nugent
- L Shimoni-Livny
- M Barysz
- M Causà
- M Meyer
- M Ziółkowski
- M-C Severen Van
- M-C Severen Van
- M-C Severen Van
- MCF Wander
- Michel Meyer
- MJ Frisch
- MKCT Nagata
- NE Christensen
- P Popelier
- P Pyykko
- R Bianchi
- RD Hancock
- RFW Bader
- S Grimme
- S Huzinaga
- S Noury
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textReduction of N2 by Fe2+ via Homogeneous and Heterogeneous Reactions Part 2: The Role of Metal Binding in Activating N2 for Reduction; a Requirement for Both Pre-biotic and Biological Mechanisms
- Author
- A Farazdel
- A Smirnov
- A Szytuta
- AD Anbar
- AD Becke
- AE Shilov
- B Hinnemann
- B Hinnemann
- B Mennucci
- BK Burgess
- BM Barney
- CRC
- D Langmuir
- D Lukoyanov
- DL Pinti
- DV Yandulov
- F Barriere
- GJ Leigh
- GJ Leigh
- HD Holland
- I Dance
- I Dance
- I Dance
- IV Kurnikov
- J Kastner
- JA Brandes
- James D. Kubicki
- JB Howard
- JCG Walker
- JM Mayer
- JW Peters
- K Fisher
- LM Francois
- M Dorr
- M Hidai
- M Strajescu
- M Strajescu
- MAA Schoonen
- Martin A. A. Schoonen
- Matthew C. F. Wander
- MC Durrant
- MCF Wander
- MD Fryzuk
- MJ Frisch
- MP Hendrich
- NG Holm
- PJ Stevens
- PS Braterman
- RA Alberty
- RA Marcus
- RD Lindberg
- RR Schrock
- S Ogo
- SF Nelsen
- SI Zones
- T Lovell
- TA Bazhenova
- TC Yang
- TH Rod
- VWA Vieira
- WW Weare
- X Jin
- YM Xiao
- ZX Cao
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textUsing molecular dynamics to quantify the electrical double layer and examine the potential for its direct observation in the in-situ TEM
- Author
- A Michaelides
- APG Kutty
- AY Toukmaji
- BL Mehdi
- CB Boothroyd
- CJ Fennell
- DA Welch
- DL Chapman
- E Kirkland
- E Spohr
- E Spohr
- E Spohr
- E Spohr
- EPM Leiva
- ER White
- G Bussi
- G Gouy
- GM Torrie
- H Dufner
- HLF Helmholtz von
- I Fukuda
- J Gale
- J Li
- JH Dunn
- JJ Howard
- JN Glosli
- JS Hansen
- KA Mkhoyan
- KJ Schweighofer
- M Ippolito
- M Winter
- MCF Wander
- MR Philpott
- N-S Choi
- P Sharma
- P Zarzycki
- PS Crozier
- QL Tang
- R Nadler
- RL Sacci
- S Toxvaerd
- SH Lee
- X Yu
- XH Liu
- Y Wu
- Y Zhou
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textImproved DFT-Based Interpretation of ESI-MS of Aqueous Metal Cations
- Author
- A Sarpola
- A Sarpola
- A Sarpola
- A Singhal
- AC Fournier
- AD Becke
- AT Sarpola
- C Lee
- CC Perry
- D Schaumloeffel
- E Cancès
- G Conti
- G Tircsó
- GI Yucelen
- H Zhao
- J Rothe
- J Saukkoriipi
- J Saukkoriipi
- J Tomasi
- JB Wehr
- JW Akitt
- JW Akitt
- L Bíró
- M Cvijović
- M Purgel
- MCF Wander
- PW Atkins
- R Turner
- R Turner
- RB Martin
- RG Parr
- S Bogatko
- S Bogatko
- S Bogatko
- S Grimme
- S Pál
- T Hedlund
- T Urabe
- T Urabe
- VB Marco Di
- W Yang
- WH Casey
- WH Casey
- WH Press
- WS Thomas
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textA density functional theory study of Fe(II)/Fe(III) distribution in single layer green rust: a cluster approach
- Author
- A Klamt
- A Klamt
- A Schäfer
- A Szabo
- A Zegeye
- AD Becke
- AD Becke
- AG Williams
- AN Thomas
- AN Thomas
- BC Christiansen
- BC Christiansen
- C Adamo
- C Lee
- C Ruby
- DL Bond
- EJ O'Loughlin
- EJ O'Loughlin
- EJ O’Loughlin
- F Trolard
- F Weigend
- HCB Hansen
- J Ai
- J Ai
- J Choi
- J GrÄFenstein
- J Tao
- JD Bernal
- JMR Génin
- JMR Génin
- JMR Génin
- JP Perdew
- JP Perdew
- K Toubal
- KB Ayala-Luis
- LL Skovbjerg
- M Abdelmoula
- M Head-Gordon
- M Swart
- M Usman
- MC Mangayayam
- MCF Wander
- MJ Frisch
- MJ Frisch
- MP Johansson
- P Refait
- P Refait
- P Refait
- PH Refait
- PJ Stephens
- R Ahlrichs
- RS Mulliken
- S Loyaux-Lawniczak
- S Loyaux-Lawniczak
- SE Pepper
- SH Vosko
- VN Staroverov
- X Liang
- X Liang
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textA molecular dynamics study of uranyl-carbonate complexes adsorbed on basal surfaces of clay minerals
- Author
- A Godelitsas
- A Ikeda
- A Kremleva
- A Kremleva
- A Krepelova
- A Krepelova
- A Rossberg
- AG Kalinichev
- B Martorell
- BJ Teppen
- BJ Teppen
- C Hennig
- C Park
- D Frenkel
- D Tunega
- DL Clark
- DM Sherman
- EA Hudson
- EJ Elzinga
- ER Sylwester
- ES Boek
- ES Boek
- F Hutschka
- G Sposito
- HC Greenwell
- HJC Berendsen
- HM Steele
- I Grenthe
- IF Vasconcelos
- J Wang
- JA Greathouse
- JA Greathouse
- JA Greathouse
- JD Kubicki
- JF Boily
- JG Catalano
- JG Catalano
- JR Bargar
- JR Bargar
- KH Lieser
- L Ciavatta
- Lei Li
- LL Ames
- M Baaden
- M Marques Fernandes
- M Schmidt
- M Walter
- M Walter
- MA Denecke
- MC Duff
- MCF Wander
- MH Baik
- NT Skipper
- O Teleman
- P Fenter
- P Guilbaud
- P Guilbaud
- R Drot
- RA Schoonheydt
- RT Cygan
- S Bachmaf
- S Doudou
- S Kerisit
- S Lectez
- SV Churakov
- T Privalov
- TD Perry
- U Gabriel
- VA Glezakou
- W Smith
- W Yang
- X Liu
- X Liu
- X Liu
- X Liu
- Xiancai Lu
- Xiandong Liu
- XY Liu
- XY Liu
- Z Jinhong
- Z Wang
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full textEnergetics of the First Life
- Author
- A Abo-Riziq
- A Bekker
- A Danchin
- A Gulick
- A Hagfeldt
- A Henglein
- A Henglein
- A Lazcano
- A Lazcano
- A Lazcano
- A Roth
- AB Chetverin
- AB Macallum
- AD Anbar
- AD Ellington
- AD Ellington
- AG Cairns-Smith
- AJ Lotka
- AK White
- AL Sobolewski
- AL Sobolewski
- AL Sobolewski
- AN Belozersky
- AS Spirin
- AS Spirin
- AV Finkelstein
- AW Schwartz
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- AY Mulkidjanian
- B Cohen
- B Jagannathan
- B Könnyű
- B Moore
- B Ohtani
- B Sherwood Lollar
- BR Eggins
- C Darwin
- C Davidovich
- C Duve de
- C Huber
- C Sagan
- C Woese
- CA Cohn
- CA Cohn
- CE Crespo-Hernandez
- CE Crespo-Hernandez
- CEJ DeRonde
- CF Meares
- CH Bennett
- CH Bennett
- CM Marian
- CR Woese
- D Glindemann
- D Mauzerall
- D Shu
- DE Bryant
- DE Bryant
- DL Pinti
- DS Kelley
- DV Dibrova
- DW Deamer
- E Biondi
- E Broda
- E Hilario
- E Schrödinger
- E Szathmáry
- E Szathmáry
- EA Curtis
- EG Nisbet
- EG Nisbet
- ES Bauer
- EV Koonin
- EV Koonin
- EV Koonin
- EV Koonin
- EV Koonin
- EV Koonin
- F Westall
- FH Crick
- G Wächtershäuser
- G Wächtershäuser
- G Wächtershäuser
- G Wächtershäuser
- G Wächtershäuser
- GA Karpov
- GA Karpov
- GF Joyce
- GW Luther
- H Hartman
- H Hartman
- H Inoue
- H Kisch
- H Kisch
- H Pech
- H Quastler
- H Reiche
- H Satzger
- H Yoneyama
- J Cadet
- J Foriel
- J Jagger
- J Pereto
- JA Brandes
- JC Cochrane
- JD Bernal
- JD Watson
- JF Kasting
- JF Nagle
- JHG Roode van
- JL Bada
- JM Bishop
- JP Ferris
- JP Gogarten
- JS Seewald
- JTH Goossen
- K Bokov
- K Takai
- K Zahnle
- KA Kormas
- L Serrano-Andres
- LA Morgan
- LE Orgel
- LE Orgel
- LE Orgel
- LE Orgel
- LM Frutos
- M Eigen
- M Halmann
- M Merchan
- M Russell
- M Russell
- M Schoonen
- M Vazquez
- MA Fox
- MA Pasek
- MAA Schoonen
- MAA Schoonen
- MCF Wander
- MCF Wander
- MI Guzman
- MJ Russell
- MJ Russell
- MJ Russell
- MJ Russell
- MK Tivey
- MS Gelfand
- MS Kritsky
- MW Powner
- N Lahav
- N Lahav
- N Lane
- NH Sleep
- NU Frigaard
- OF Kardanova
- P Glansdorff
- PJ Darlington Jr
- PK Bridson
- R Landauer
- R Saladino
- R Saladino
- RJP Williams
- RK Thauer
- RK Thauer
- S Branciamore
- S Granick
- S Marinkovic
- S Metz
- S Perun
- S Perun
- S Perun
- S Petersen
- SA Benner
- SD Senanayake
- SE Shnol
- SJ Maynard
- SL Miller
- SL Miller
- ST Bayley
- T Inoue
- T Meier
- T Murata
- TA Lincoln
- TA Steitz
- TH Haines
- TW Conway
- U Nagaswamy
- VP Skulachev
- VP Skulachev
- VP Skulachev
- W Buckel
- W Gilbert
- W Martin
- W Martin
- WA Cramer
- WG Scott
- WJ Hagan Jr
- WN Konings
- X Chen
- XF Liu
- XV Zhang
- XV Zhang
- Y Koga
- Y Xu
- YI Wolf
- YV Natochin
- Z Borowska
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
No full text
