1. Atomistic Study of Wet-heat Resistance of Calcium Dipicolinate in the Core of Spores. (15th January 2018) Authors: Mishra, Ankit; Rajak, Pankaj; Tiwari, Subodh; Sheng, Chunyang; Krishnamoorthy, Aravind; Nakano, Aiichiro; Kalia, Rajiv; Vashishta, Priya Journal: MRS advances Issue: Volume 3:Number 26(2018) Page Start: 1457 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Efficient Discovery of Optimal N-Layered TMDC Hetero-Structures. (5th March 2018) Authors: Bassman, Lindsay; Rajak, Pankaj; Kalia, Rajiv K.; Nakano, Aiichiro; Sha, Fei; Aykol, Muratahan; Huck, Patrick; Persson, Kristin; Sun, Jifeng; Singh, David J.; Vashishta, Priya Journal: MRS advances Issue: Volume 3:Number 6/7(2018) Page Start: 397 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Flexible polyolefin dielectric by strategic design of organic modules for harsh condition electrification. Issue 3 (15th February 2022) Authors: Deshmukh, Ajinkya A.; Wu, Chao; Yassin, Omer; Mishra, Ankit; Chen, Lihua; Alamri, Abdullah; Li, Zongze; Zhou, Jierui; Mutlu, Zeynep; Sotzing, Michael; Rajak, Pankaj; Shukla, Stuti; Vellek, John; Baferani, Mohamadreza Arab; Cakmak, Mukerrem; Vashishta, Priya; Ramprasad, Rampi; Cao, Yang; Sotzing, ... Journal: Energy & environmental science Issue: Volume 15:Issue 3(2022) Page Start: 1307 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Molecular Simulation of MoS2 Exfoliation. Issue 1 (December 2018) Authors: Zhou, Guoqing; Rajak, Pankaj; Susarla, Sandhya; Ajayan, Pulickel; Kalia, Rajiv; Nakano, Aiichiro; Vashishta, Priya Journal: Scientific reports Issue: Volume 8:Issue 1(2018) Page Start: 1 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Neural Network Analysis of Dynamic Fracture in a Layered Material. (2nd January 2019) Authors: Rajak, Pankaj; Kalia, Rajiv K.; Nakano, Aiichiro; Vashishta, Priya Journal: MRS advances Issue: Volume 4:Number 19(2019) Page Start: 1109 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Quantum Molecular Dynamics Validation of Nanocarbon Synthesis by High-Temperature Oxidation of Nanoparticles. Issue 24 (6th June 2016) Authors: Sheng, Chunyang; Nomura, Kenichi; Rajak, Pankaj; Nakano, Aiichiro; Kalia, Rajiv K.; Vashishta, Priya Journal: MRS advances Issue: Volume 1:Issue 24(2016) Page Start: 1811 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Reactive molecular dynamics simulations and machine learning. (March 2020) Authors: Krishnamoorthy, Aravind; Rajak, Pankaj; Hong, Sungwook; Nomura, Ken-ichi; Tiwari, Subodh; Kalia, Rajiv K; Nakano, Aiichiro; Vashishta, Priya Journal: Journal of physics Issue: Volume 1461(2020) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗