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SIGNAL_CIRSI WWW Interface (24-Sept-1998)
https://people.ast.cam.ac.uk/~rgm/forms/cirsi/signal_cirsi_form.html25 Mar 2002: SIGNAL_CIRSI WWW FORM. This is a WWW interface to the program signal_cirsi. If you want to run the standalone Fortran version the information about acquiring the Fortran version is provided on the Help Page. The cgi is script is -
Bibliography
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper13/node11.html28 Oct 2002: Springborg M 2001 Chem. Phys. Lett. 339, 389. 24. ... Paine RT and Sneddon LG 1994 CHEMTECH 24 29. 35. -
Total energy optimisation
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper11/node3.html31 Oct 2002: 24). where. is the weight associated with each grid point. Here a contravariant-to-covariant tensor correction is needed when this gradient is used to calculate the search direction during a ... restricted to its spherical region. For this reason in -
Bibliography
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper11/node10.html31 Oct 2002: J. Quantum Chem. 65, 453 (1997). 24. -
Bibliography
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper8/node7.html31 Oct 2002: Johns Hopkins University Press, Baltimore, 1996). 24. -
Total energy optimisation
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper10/node11.html29 Oct 2002: Our implementation follows the simplified version of Millam and Scuseria [24]. -
Energetics
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper13/node5.html28 Oct 2002: BN systems. Benzene. 2.24. 1.99. Borazine. PPV. 2.22. 1.98. PVB. PPP. -
The NGWF pseudopotential plane-wave method in practice
www.tcm.phy.cam.ac.uk/~pdh1001/papers/paper11/node5.html31 Oct 2002: The equilibrium bond length for this case differs by 3.34% from CASTEP, as compared to -1.24% for the. -
www.damtp.cam.ac.uk/user/ngb23/publications/names_n.txt
www.damtp.cam.ac.uk/user/ngb23/publications/names_n.txt18 Nov 2002: ODC 24. TH 25. NOS 26. GRa1 27. GRa2 28. GRa3 29. -
14-Sep-2002 WMY added the header "XID XMM data related ...
https://people.ast.cam.ac.uk/~xmmssc/xidops/changelog-index.html14 Sep 2002: fields studied in XID ' 24-Jan-2002 WMY added Known problems and warnings about the XID imaging data page 24-Nov-2001 rgm changed order of entries in this file so
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