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003			VRT
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008			130527s2011 enka b 001 0 eng
010			_a2010-046409
020			_a9781107001701 (hardback)
035			_a16523981
039		9	_a201502081433 _bVLOAD _c201305310950 _dyenh _c201305301611 _dhoant_tttv _c201305301610 _dhoant_tttv _y201305271606 _zthupt
040			_aDLC _cDLC _dDLC
041			_aeng
042			_apcc
044			_aUS
050	0	0	_aQC176.8.N35 _bV37 2011
082	0	0	_a530.0285 _bVAR 2011 _222
084			_aSCI040000 _2bisacsh
090			_a530.0285 _bVAR 2011
100	1		_aVarga, Kalman, _d1963-
245	1	0	_aComputational nanoscience : _b applications for molecules, clusters, and solids / _cKálmán Varga and Joseph A. Driscoll.
260			_aCambridge ; _aNew York : _bCambridge University Press, _c2011.
300			_axii, 431 p. : _bill. ; _c26 cm.
504			_aIncludes bibliographical references (p. [409]-427) and index.
505	8		_aMachine generated contents note: Preface; Part I. 1D Problems: 1. Variational solution of the Schrödinger equation; 2. Solution of bound state problems using a grid; 3. Solution of the Schrödinger equation for scattering states; 4. Periodic potentials: band structure in 1D; 5. Solution of time-dependent problems in quantum mechanics; 6. Solution of Poisson's equation; Part II. 2D and 3D Systems: 7. 3D real space approach: from quantum dots to Bose-Einstein condensates; 8. Variational calculations in 2D: quantum dots; 9. Variational calculations in 3D: atoms and molecules; 10. Monte Carlo calculations; 11. Molecular dynamics simulations; 12. Tight binding approach to electronic structure calculations; 13. Plane wave density functional calculations; 14. Density functional calculations with atomic orbitals; 15. Real-space density functional calculations; 16. Time-dependent density functional calculations; 17. Scattering and transport in nanostructures; 18. Numerical linear algebra; Appendix: code descriptions; References; Index.
650		0	_aNanostructures _xData processing.
650		0	_aPhysics _xData processing.
650		0	_aComputer algorithms.
650		7	_aSCIENCE / Mathematical Physics _2bisacsh.
653			_aVật lý
653			_aCấu trúc Nano
653			_aThuật toán
653			_aXử lý dữ liệu
700	1		_aDriscoll, Joseph Andrew, _d1974-
856	4	2	_3Cover image _uhttp://assets.cambridge.org/97811070/01701/cover/9781107001701.jpg
906			_a7 _bcbc _corignew _d1 _eecip _f20 _gy-gencatlg
911			_aNguyễn Thị Hòa
912			_aHoàng Yến
925	0		_aacquire _b2 shelf copies _xpolicy default
925			_aG
926			_a0
927			_aSH
942			_c1
955			_bre04 2010-10-29 _cre04 2010-10-29 ONIX to Gen. Science _dxh07 2010-12-02 to Dewey _wrd11 2010-12-02 _axd07 2011-07-02 1 copy rec'd., to CIP ver. _fxh04 2011-08-26 Z-CipVer To CALM _txh04 2011-08-26 copy 2 added
999			_c358040 _d358040