| layout | title | root |
|---|---|---|
page |
Resources |
. |
| Software | Links |
|---|---|
| Libra | Website (Code and Installation) |
| Newton-X | Official website |
| NEXMD | Source code and instructions |
| nano-qmflows | Official documentation |
| QXMD | Tutorials |
| CAT and FOX | CAT source |
| DFTB+ | Official website |
| CP2k | Official website |
| Quantum Espresso (QE) | Official website |
| COLUMBUS | Official website |
| ErgoSCF | Official website |
| Name | Affiliation | Role and Software |
|---|---|---|
| Dr. Alexey Akimov | University at Buffalo (UB), USA | Workshop coordinator, Instructor for Libra, DFTB+, ErgoSCF, CP2k, QXMD, etc. |
| Ms. Jeanette Sperhac | University at Buffalo Center for Computational Research (UB CCR), USA | Workshop coordinator, Instructor for Jupyter, Open OnDemand, UB CCR HPC |
| Dr. Sudhakar Pamidighantam | Indiana University, USA | Instructor for SEAGrid platform |
| Dr. Sergei Tretiak | Los Alamos National Laboratory, USA | Instructor for NEXMD |
| Dr. Walter Malone | Los Alamos National Laboratory, USA | Instructor for NEXMD |
| Dr. Ivan Infante | Istituto Italiano di Tecnologia, Italy | Instructor for CAT, FOX, nano-qmflows, CP2k |
| Dr. Felipe Zapata | Netherlands eScience Center, Netherlands | Instructor for CAT, FOX, nano-qmflows, CP2k |
| Dr. Hans Lischka | Texas Tech University, USA | Instructor for COLUMBUS, Newton-X |
| Dr. Mario Barbatti | Aix-Marseille University, France | Instructor for Newton-X, DFTB+ |
| Dr. Ljiljana Stojanovic | University College London, UK | Instructor for Newton-X, DFTB+ |
| Dr. Amber Jain | IIT Bombay, India | Instructor for HEOM |
| Dr. Aiichiro Nakano | University of Southern California, USA | Instructor for QXMD |
| Mr. Mohammad Shakiba | Shahid Bahonar University of Kerman, Iran | Co-instructor for CP2k, Libra/CP2k |
| Mr. Bas van Beek | Vrije Universiteit Amsterdam, Netherlands | Co-instructor for CAT, FOX, nano-qmflows |
| Ms. Juliette Zito | Istituto Italiano di Tecnologia, Italy | Co-instructor for nano-qmflows |
| Ms. Roberta Pascazio | Istituto Italiano di Tecnologia, Italy | Co-instructor for CAT, FOX |
| Dr. Reed Nieman | Texas Tech University, USA | Co-instructor for COLUMBUS |
| Mr. Thomas Linker | Unisversity of Southern California, USA | Co-instructor for QXMD |
| Ms. Dori Sajdak | University at Buffalo Center for Computational Research (UB CCR), USA | UB CCR system administrator, VPN, accounts, etc. |
| Ms. Cynthia Cornelius | University at Buffalo Center for Computational Research (UB CCR) | UB CCR system administrator, program installation |