NanoDCAL and Rescu S W with 2 GUI 106349204

The Department of Higher Education has published a tender for "NanoDCAL and Rescu S/W with 2 GUI" on the 27 Sep 2024. This tender belongs to DFT Gauges category. This tender is published in Dakshina Kannada, Karnataka location. The vendors interested in this tender and related DFT Gauges tenders can obtain further details by registering in the Tendersniper web portal. Upon registration, Tendersniper sends regular tender alerts by email specifically addressing the user requirements (i.e., keywords, location and value range). Government business is a growing area of opportunity. The businesses are encouraged to actively monitor tender opportunities and participate in them to grow their business.
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Tender Details
 Tender Title / Description
Tender Title NanoDCAL and Rescu S/W with 2 GUI
Tender Description nanomaterial and nanoscale device simulation(rescu+ and nanodcal+ software)software should be able simulate all atoms in a material using density functional theory (dft) focusing onmolecular dynamics (md) and other ion dynamics using rescu+ software.1. software should be able to calculate electronic structure with aimd and nudged elastic band method (neb) with python api to an efficient and optimized fortran core, plus a dedicated al module.software should have following below feature:1. should offers better than ever parallelism and improved calculation times especially on clusters and supercomputers by at least one order of magnitude *.2. convenient python api to efficient fortran core3. improved parallelism, hardware portability, and performance4. focus on very large atomistic systems up to 20k+ atoms5. dipole moment, mulliken populations6. molecular dynamics, machine learning (aimd/mlmd)7. structure relaxation, nudged elastic band8. density, dos/pdos, ldos, projected ldos9. band st
Comments nanomaterial and nanoscale device simulation(rescu+ and nanodcal+ software)software should be able simulate all atoms in a material using density functional theory (dft) focusing onmolecular dynamics (md) and other ion dynamics using rescu+ software.1. software should be able to calculate electronic structure with aimd and nudged elastic band method (neb) with python api to an efficient and optimized fortran core, plus a dedicated al module.software should have following below feature:1. should offers better than ever parallelism and improved calculation times especially on clusters and supercomputers by at least one order of magnitude *.2. convenient python api to efficient fortran core3. improved parallelism, hardware portability, and performance4. focus on very large atomistic systems up to 20k+ atoms5. dipole moment, mulliken populations6. molecular dynamics, machine learning (aimd/mlmd)7. structure relaxation, nudged elastic band8. density, dos/pdos, ldos, projected ldos9. band st
 Important Dates
Published Date
Due Date 15 Oct 2024 00:00:00
 Estimate and EMD
Estimated Value 0.0
EMD 0 INR
Processing Fee 0 INR
 Document Links
 Purchasing Agency
 Tender No

TSID: 106349204

 Tender Type and Location
Tender Category
Tender Type
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