Search Results: PWscf
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Quantum ESPRESSO
Jumat, 2026-01-09 17:05:07functions of QE are provided by the PWscf component (PWscf previously existed as an independent project). PWscf (Plane-Wave Self-Consistent Field) is...
Click to read more »Simplified Molecular Input Line Entry System
Senin, 2026-07-06 11:15:12ORCA (academic) OpenMolcas PARSEC PSI PyQuante PySCF Quantum ESPRESSO (PWscf) RMG SIESTA VB2000 YAMBO code Proprietary ADF AMPAC DMol3 CADPAC CASINO...
Click to read more »Glide (docking)
Sabtu, 2023-08-12 15:31:31ORCA (academic) OpenMolcas PARSEC PSI PyQuante PySCF Quantum ESPRESSO (PWscf) RMG SIESTA VB2000 YAMBO code Proprietary ADF AMPAC DMol3 CADPAC CASINO...
Click to read more »RDKit
Kamis, 2026-04-09 12:08:32ORCA (academic) OpenMolcas PARSEC PSI PyQuante PySCF Quantum ESPRESSO (PWscf) RMG SIESTA VB2000 YAMBO code Proprietary ADF AMPAC DMol3 CADPAC CASINO...
Click to read more »QMCPACK
Rabu, 2026-06-24 12:39:48pw2qmcpack addon. This converter exports orbitals from Quantum ESPRESSO's PWSCF module into an HDF5 format readable by QMCPACK. Gaussian-basis Codes: The...
Click to read more »DP code
Rabu, 2026-04-08 15:19:25software open-source academic for free license. ABINIT EXC code YAMBO code PWscf Quantum chemistry computer programs "DP Code". dp-code.org. Retrieved 8...
Click to read more »Index of physics articles (P)
Sabtu, 2024-12-28 23:21:09B1828-10 PSR B1913+16 PSR J0737-3039 PSR J1614–2230 PUREX PVLAS PVT (physics) PWscf PYTHIA Padma Kant Shukla Padre Bancalari Painlevé paradox Pair-instability...
Click to read more »YAMBO code
Senin, 2026-07-27 01:55:00Yambo is interfaced with plane-wave density-functional codes: ABINIT, PWscf, CPMD and with the ETSF-io library. The utilities that interface these codes...
Click to read more »EXC code
Rabu, 2022-07-20 10:02:25It is distributed under the GNU/GPL license. ABINIT DP code YAMBO code PWscf Quantum chemistry computer programs http://www.bethe-salpeter.org v t e...
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