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'International Symposium on Atomic, Molecular and Optical Sciences & High Performance Computing: A Seamless Frontier' January 10-12, 2008 Vedic Village, Kolkata January 10, 2008 Inaugural Session 8.30 AM – 9.00 AM : Inaugural address by Debashis Mukherjee 9.00 AM – 9.45 AM : Martin Quack Theory and Spectroscopy of Parity Violation in Chiral Molecules 9.45 AM – 10.00 AM : Break Session I (Precision Spectroscopy) Chairperson: P N Ghosh 10.00 AM – 10.35 AM : Deepak Mathur Interaction of matter with light, and of light with matter 10.40 AM – 11.15 AM : Lokesh Trivedi Probing molecules with fast ions : recent advances 11.20 AM – 11.35 AM : Tea Session – II (Materials Chemistry and Physics) Chairperson: D D Sarma 11.35 AM – 12.10 PM : Supriyo Datta Quantum Transport as a Process of Successive Entanglement and Disentanglement 12.15 PM – 12.50 PM : Hans Agren Multiphysics Modeling of Optical Properties: Molecules and Nanoparticles 1.00 PM – 2.00 PM : Lunch Session – III (Electronic Structure A) Chairperson: Wesley Allen 2.00 PM – 2.35 PM : Bhanu P Das Atomic Tests of the Standard Model of Particle Physics 2.40 PM – 3.15 PM : Garnet Chan Tensor Network Wavefunctions 3.20 PM – 3.40 PM : Coffee Session – IV ( Density Functional Theory : Methodologies) Chairperson: Wenjian Liu 3.40 PM – 4.15 PM : Swapan Kumar Ghosh Density Functional Theory Scales at Different Length 4.20 PM – 4.55 PM : Martin Head-Gordon Advances in practical density functional theory calculations 5.00 PM – 6.00 PM Poster Session (Chairperson: D S Ray) 6.30 PM – 7.15 PM Evening Lecture Werner Kutzelnigg Rate of convergence of basis expansions in quantum chemistry January 11, 2008 Session – V (Condensed Matter Systems) Chairperson: Hans Agren 9.00 AM – 9.35 AM: Ole K Andersen LDA+DMFT description of the metal-insulator transition in V2O3 9.40 AM – 10.15 AM : S Balasubramanian Computer Simulations of Ionic Liquids 10.15 AM – 10.30 AM : Tea Session – VI (Electronic Structure B) Chairperson: Bhanu P Das 10.40 AM – 11.15 AM : Wesley D Allen State-Specific Multireference Coupled Cluster Theories: Maturation into Robust Methods for General Chemical Applications 11.20 AM – 11.55 AM : Sourav Pal Multi-reference coupled-cluster approach: High performance electronic structure method for spectra and properties 12.00 noon – 1.00 PM: Lunch 1.30 PM – 4.30 PM: Excursion Session – VII (Quantum Dynamics) Chairperson: Sourav Pal 5.00 PM – 5.35 PM: Wenjian Liu 80 Years after Dirac: Relativity in Chemistry and Physics Is Done 5.40 PM – 6.15 PM : Andy Simmonett Ab Initio Characterization of the Newly Synthesized Hydroxymethylene Molecule 6.20 PM – 6.30 PM: Tea 6.30 PM – 7.30 PM : Poster Session (Chairperson: D S Ray) 7.30 PM onwards Cultural Show and Banquet January 12, 2008 Session – VIII (Materials Chemistry and Physics) Chairperson: G P Das 9.00 AM – 9.35 AM : Rajiv K Kalia Atomistic Mechanisms of Deformation, Fracture and Nanoductility in Silica Glass 9.40 AM – 10.15 AM: Krishnan Raghavachari Electronic Structure Studies of Materials Chemistry using Novel Embedded Cluster Models 10.20 AM – 10.55 AM : Indra Das Gupta Magnetism in low dimensional oxides: A perspective from first principle calculations 11.00 AM – 11.10 AM: Tea Session – IX (Electronic Structure B) Chairperson: Werner Kutzelnigg 11.10 AM – 11.45 AM : Seiichiro Ten-No Explicitly correlated Slater-type geminal theory 11.50 AM – 12.25 PM: Jozef Noga R12/F12 based theories within and beyond the standard approximation. An analysis and some numbers 12.30 PM – 1.05 PM: Wim Klopper Many-body perturbation theory and coupled-cluster methods with Slater-type geminals 1.10 PM – 2.10 PM: Lunch Session – X (Electronic Structure B) Chairperson: S P Bhattacharyya 2.15 – 2.50 PM: Franceso Evangelista Triple excitations in state-specific multireference coupled cluster theory 2.55 – 3.30 PM: Michael Hanrath Recent advances in the MRexpT approach 3.30 PM – 3.45 PM: Tea Session – XI (Electronic Structure B) Chairperson: P K Mukherjee 3.45 PM – 4.20 PM: Dimitri Batani Generation and transport of relativistic electrons in ultra-high-intensity laser-matter interaction 4.25 PM – 5.00 PM: Horst Koeppel Multiple conical intersections and multi-state nonadiabatic dynamics in benzenoid cations 5.05 PM – 5.20 PM : Tea 5.20 PM – 6 PM: Valedictory Session 7.00 PM Dinner