1. A DFT study of the effect of OH groups on the optical, electronic, and structural properties of TiO2 nanoparticles. Issue 7 (22nd January 2015) Authors: Miroshnichenko, Olga; Auvinen, Sami; Alatalo, Matti Journal: Physical chemistry chemical physics Issue: Volume 17:Issue 7(2015) Page Start: 5321 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A DFT study of the effect of SO4 groups on the properties of TiO2 nanoparticles. Issue 48 (25th November 2016) Authors: Miroshnichenko, Olga; Posysaev, Sergei; Alatalo, Matti Journal: Physical chemistry chemical physics Issue: Volume 18:Issue 48(2016) Page Start: 33068 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Adsorption of CO2 on the ω-Fe (0001) surface: insights from density functional theory. Issue 12 (10th February 2021) Authors: Aravindh, S. Assa; Cao, Wei; Alatalo, Matti; Huttula, Marko; Kömi, Jukka Journal: RSC advances Issue: Volume 11:Issue 12(2021) Page Start: 6825 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Density functional theory study of ω phase in steel with varied alloying elements. Issue 13 (26th March 2020) Authors: Sasikala Devi, Assa Aravindh; Pallaspuro, Sakari; Cao, Wei; Somani, Mahesh; Alatalo, Matti; Huttula, Marko; Kömi, Jukka Journal: International journal of quantum chemistry Issue: Volume 120:Issue 13(2020) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Incorporation of Si atoms into CrCoNiFe high-entropy alloy: a DFT study. (1st February 2021) Authors: Aravindh, S Assa; Kistanov, Andrey A; Alatalo, Matti; Kömi, Jukka; Huttula, Marko; Cao, Wei Journal: Journal of physics Issue: Volume 33:Number 13(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Metallic Contact between MoS2 and Ni via Au Nanoglue. Issue 22 (24th April 2018) Authors: Shi, Xinying; Posysaev, Sergei; Huttula, Marko; Pankratov, Vladimir; Hoszowska, Joanna; Dousse, Jean‐Claude; Zeeshan, Faisal; Niu, Yuran; Zakharov, Alexei; Li, Taohai; Miroshnichenko, Olga; Zhang, Meng; Wang, Xiao; Huang, Zhongjia; Saukko, Sami; González, Diego López; van Dijken, Sebastiaan; Alat... Journal: Small Issue: Volume 14:Issue 22(2018) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Metal‐Semiconductor Contacts: Metallic Contact between MoS2 and Ni via Au Nanoglue (Small 22/2018). Issue 22 (28th May 2018) Authors: Shi, Xinying; Posysaev, Sergei; Huttula, Marko; Pankratov, Vladimir; Hoszowska, Joanna; Dousse, Jean‐Claude; Zeeshan, Faisal; Niu, Yuran; Zakharov, Alexei; Li, Taohai; Miroshnichenko, Olga; Zhang, Meng; Wang, Xiao; Huang, Zhongjia; Saukko, Sami; González, Diego López; van Dijken, Sebastiaan; Alat... Journal: Small Issue: Volume 14:Issue 22(2018) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Modeling TiO2׳s refractive index function from bulk to nanoparticles. (December 2015) Authors: Jalava, Juho-Pertti; Taavitsainen, Veli-Matti; Lamminmäki, Ralf-Johan; Lindholm, Minna; Auvinen, Sami; Alatalo, Matti; Vartiainen, Erik; Haario, Heikki Journal: Journal of quantitative spectroscopy & radiative transfer Issue: Volume 167(2016:May) Page Start: 105 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Re-examining the giant magnetization density in α′′-Fe16N2 with the SCAN+U method. Issue 29 (19th July 2022) Authors: Devi, Assa Aravindh Sasikala; Nokelainen, Johannes; Barbiellini, Bernardo; Devaraj, Murali; Alatalo, Matti; Bansil, Arun Journal: Physical chemistry chemical physics Issue: Volume 24:Issue 29(2022) Page Start: 17879 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Synergistic effect of Ni–Ag–rutile TiO2 ternary nanocomposite for efficient visible-light-driven photocatalytic activity. Issue 60 (7th October 2020) Authors: Leukkunen, Petri M.; Rani, Ekta; Sasikala Devi, Assa Aravindh; Singh, Harishchandra; King, Graham; Alatalo, Matti; Cao, Wei; Huttula, Marko Journal: RSC advances Issue: Volume 10:Issue 60(2020) Page Start: 36930 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗