Bibliography
ABOUT BIBLIOGRAPHY
Things have turn more complicated lately and the options on January 2018 are:
- We have to connect everywhere through Sabidi acces from the URV.
1.- To connect ISI web of knowledge, you have two possibilities:
A. going through the sabidi: http://www.urv.cat.sabidi.urv.cat/ca/vida-campus/serveis/crai/ and go to bottom of the page and choose the last option of the middle column B. Connect to Web of knowledge page and there in acces
need to connect through the Spanish "Ministerio de Ciencia e Innovación". Use the web page:
http://www.accesowok.fecyt.es/login/
from any computer in ICIQ. If you want to use it from home you will need to use the ICIQ's proxy, please look at the Connecting from Outside section.
2.-
3.- The SciFinder Scholar, is not available any-more from the Terminal Server, Guest's computer or any other ICIQ's windows computer. The use is restricted to the web interface
https://origin-scifinder.cas.org/scifinder/login
To use it, you will need to create yourselves an account through the ICIQ's intranet. To do so: 1) enter to the intranet (you will need your ICIQ's intranet user and password, please check Intranet) 2) Look for "Management", inside this "IT", and there "Scifinder registration". Introduce your data and that's all!
Both paper searchers are very useful, fast and reliable. Maybe the main advantage of the second is that you can draw compounds, and it searches molecules/reactions containing the molecule you have drawn. The data bases were they search are of course different.
ACCESS TO JOURNALS
We have access to most e-journals, but if you need some paper we do not have access to, you can ask Núria V. to get it from the URV university. It will take from 2 or 3 days to 3 weeks to arrive. If you can also check if it is in the URV library (http://cataleg.urv.cat/search) and pick it yourself.
Please, note Error on access to electronic journals
Alternative access SCI-HUB (thanks Franziska)
COMPUTATIONAL GROUPS AND ICIQ'S BOOKS AND JOURNALS
You can see a list of the books in the computational lab at: File:INVENTARI DE LLIBRES GRUPS.pdf). You can use them in the lab, but if you need to take them home or you’re going to be using one for a long time in the lab, please fill in the form you’ll find in the cabinet (remember to fill in the date when you return the book!). Books are for everyone to use, so please don't "store"/"hide" them on your desks because another person might need it and we go crazy looking for "missing" books. Ideally you should put the books back in the cabinet when you leave and take them again next day if you still need them.
We've also got a few ebooks, ask Núria V. for an e-copy, see list here: File:E-books.pdf.
ICIQ also has an extensive bibliography database. There’s a printed copy on the notice board but you can also check the list here: File:Bibliography ICIQ.pdf
SELECTED PAPERS:
- Fundamentals of Plane Wave calculations: [1]
- Test on functionals: [2]
- CI-NEB: d-band model: [3]
- Bayesian: [7]
- Interesting review on the accuracy of quantum chemical methods.File:A priori calculation molecular properties-Helgaker-04.pdf
- d and f polarization function basis sets by Frenking and coworkers. File:1993-CPL-208-237.pdf, File:1993-CPL-208-111.pdf, and a correction File:1994-CPL-224-603.pdf