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Experimental and theoretical evidence for an ionic crystal of ammonia at high pressure

Physical review. B, Condensed matter and materials physics, 2014-05, Vol.89 (17), Article 174103

2014

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Population analysis of plane-wave electronic structure calculations of bulk materials

Physical review. B, Condensed matter, 1996-12, Vol.54 (23), p.16317-16320

1996

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EPR g -tensor of paramagnetic centers in yttria-stabilized zirconia from first-principles calculations

Physical review. B, Condensed matter and materials physics, 2006-04, Vol.73 (13), Article 134112

2006

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Extrapolative approaches to Brillouin-zone integration

Physical review. B, Condensed matter, 1999-02, Vol.59 (7), p.4685-4693

1999

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Theoretical investigation of xenon-hydrogen solids under pressure using ab initio DFT and GW calculations

Physical review. B, Condensed matter and materials physics, 2011-09, Vol.84 (9), p.092101

2011

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Electron energy-loss spectroscopy of electron states in isolated carbon nanostructures

Physical review. B, Condensed matter, 2001-04, Vol.63 (16), Article 165408

2001

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All-electron magnetic response with pseudopotentials: NMR chemical shifts

Physical review. B, Condensed matter, 2001-06, Vol.63 (24), Article 245101

2001

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First-principles method for impurities in quantum fluids: Positron in an electron gas

Physical review. B, Condensed matter and materials physics, 2010-07, Vol.82 (3), Article 035107

2010

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Dense close-packed phase of tin above 157 GPa observed experimentally via angle-dispersive x-ray diffraction

Physical review. B, Condensed matter and materials physics, 2011-10, Vol.84 (14), Article 140104

2011

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Theoretical investigation of xenon-hydrogen solids under pressure using ab initio DFT and G W calculations

Physical review. B, Condensed matter and materials physics, 2011-09, Vol.84 (9), Article 092101

2011

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Cubic boron nitride: Experimental and theoretical energy-loss near-edge structure

Physical review. B, Condensed matter, 2001-09, Vol.64 (11), Article 115107

2001

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Thermodynamically stable lithium silicides and germanides from density functional theory calculations

Physical review. B, Condensed matter and materials physics, 2014-08, Vol.90 (5), Article 054111

2014

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Lithiation of silicon via lithium Zintl-defect complexes from first principles

Physical review. B, Condensed matter and materials physics, 2013-05, Vol.87 (17), Article 174108

2013

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Energetics of hydrogen/lithium complexes in silicon analyzed using the Maxwell construction

Physical review. B, Condensed matter and materials physics, 2011-12, Vol.84 (22), Article 224106

2011

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Theory of core-hole effects in 1 s core-level spectroscopy of the first-row elements

Physical review. B, Condensed matter and materials physics, 2008-03, Vol.77 (11), Article 115122

2008

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Experimental and theoretical evidence for an ionic crystal of ammonia at high pressure

Population analysis of plane-wave electronic structure calculations of bulk materials

EPR g -tensor of paramagnetic centers in yttria-stabilized zirconia from first-principles calculations

Extrapolative approaches to Brillouin-zone integration

Theoretical investigation of xenon-hydrogen solids under pressure using ab initio DFT and GW calculations

Electron energy-loss spectroscopy of electron states in isolated carbon nanostructures

All-electron magnetic response with pseudopotentials: NMR chemical shifts

First-principles method for impurities in quantum fluids: Positron in an electron gas

Dense close-packed phase of tin above 157 GPa observed experimentally via angle-dispersive x-ray diffraction

Theoretical investigation of xenon-hydrogen solids under pressure using ab initio DFT and G W calculations

Cubic boron nitride: Experimental and theoretical energy-loss near-edge structure

Thermodynamically stable lithium silicides and germanides from density functional theory calculations

Lithiation of silicon via lithium Zintl-defect complexes from first principles

Energetics of hydrogen/lithium complexes in silicon analyzed using the Maxwell construction

Theory of core-hole effects in 1 s core-level spectroscopy of the first-row elements

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