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Efficient localized basis set for quantum Monte Carlo calculations on condensed matter

Physical review. B, Condensed matter and materials physics, 2004-10, Vol.70 (16), p.161101.1-161101.4, Article 161101

2004

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Quantum Monte Carlo calculations of the structural properties and the B1-B2 phase transition of MgO

Physical review. B, Condensed matter and materials physics, 2005-07, Vol.72 (1), p.014114.1-014114.7, Article 014114

2005

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Structure and dynamics of liquid iron under Earth’s core conditions

Physical review. B, Condensed matter, 2000-01, Vol.61 (1), p.132-142

2000

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Exchange-correlation energy and the phase diagram of Si

Physical review. B, Condensed matter, 2003-11, Vol.68 (20), Article 205212

2003

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Linear-scaling density-functional-theory technique: The density-matrix approach

Physical review. B, Condensed matter, 1996-03, Vol.53 (11), p.7147-7157

1996

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Bulk and surface energetics of crystalline lithium hydride: Benchmarks from quantum Monte Carlo and quantum chemistry

Physical review. B, Condensed matter and materials physics, 2010-10, Vol.82 (16), Article 165431

2010

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Thermodynamics of hexagonal-close-packed iron under Earth’s core conditions

Physical review. B, Condensed matter, 2001-07, Vol.64 (4), Article 045123

2001

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Calculation of properties of crystalline lithium hydride using correlated wave function theory

Physical review. B, Condensed matter and materials physics, 2009-10, Vol.80 (16), Article 165109

2009

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Structural stability of silica at high pressures and temperatures

Physical review. B, Condensed matter and materials physics, 2005-02, Vol.71 (6), p.064104.1-064104.8, Article 064104

2005

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Ionic and electronic processes at ionic surfaces induced by atomic-force-microscope tips

Physical review. B, Condensed matter, 1997-12, Vol.56 (23), p.15332-15344

1997

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Efficient localized basis set for quantum Monte Carlo calculations on condensed matter

Quantum Monte Carlo calculations of the structural properties and the B1-B2 phase transition of MgO

Structure and dynamics of liquid iron under Earth’s core conditions

Exchange-correlation energy and the phase diagram of Si

Linear-scaling density-functional-theory technique: The density-matrix approach

Bulk and surface energetics of crystalline lithium hydride: Benchmarks from quantum Monte Carlo and quantum chemistry

Thermodynamics of hexagonal-close-packed iron under Earth’s core conditions

Calculation of properties of crystalline lithium hydride using correlated wave function theory

Structural stability of silica at high pressures and temperatures

Ionic and electronic processes at ionic surfaces induced by atomic-force-microscope tips

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