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34篇 您的检索式:作者名="Holmes CS"
    题名 作者 年代 出处 被引量
1Machine-learned interatomic potentials by active learning:amorphous and liquid hafnium dioxide显示文摘We propose an active learning scheme for automatically sampling a minimum number of uncorrelated configurations for fitting the Gaussian Approximation Potential(GAP).Our active learning scheme consists of an unsupervised machine learning(ML)scheme coupled with a Bayesian optimization technique that evaluates the GAP model.We apply this scheme to a Hafnium dioxide(HfO2)dataset generated from a“melt-quench”ab initio molecular dynamics(AIMD)protocol.Our results show that the active learning scheme,with no prior knowledge of the dataset,is able to extract a configuration that reaches the required energy fit tolerance.Further,molecular dynamics(MD)simulations performed using this active learned GAP model on 6144 atom systems of amorphous and liquid state elucidate the structural properties of HfO2 with near ab initio precision and quench rates(i.e.,1.0 K/ps)not accessible via AIMD.The melt and amorphous X-ray structural factors generated from our simulation are in good agreement with experiment.In addition,the calculated diffusion constants are in good agreement with previous ab initio studies.Ganesh Sivaraman Anand Narayanan Krishnamoorthy Matthias Baur Christian Holm Marius Stan Gábor Csányi Chris Benmore Álvaro Vázquez-Mayagoitia 2020npj Computational Materials2020,,1:10
2Orthostatic hypotension from sympathetic denervation in Parkinson's disease显示文摘Goldstein DS Holmes CS Dendi R 2002Neurology2002,58,8:1
3Investigating childhood leukemia in Churchill County,Nevada显示文摘 Holmes AK Belson MG 2007Environ Health Perspect2007,115,1:1
4Prefrontal func-tioning during context processing in schizophrenia and majordepression : an event-related fMRI study 显示文摘Holmes AJ Macdonald A Carter CS 2005SchizophreniaResearch2005,76,23:1
5Small for gestational age is not a diagnosis显示文摘Soothill PW Bobrow CS Holmes R 1999Ultrasound Obstet Gynecol1999,13,:1
6Gender Differences in memory and learning in children with Insulin-Dependent Diabetes Menitus(IDDM) over a 4-year follow-up interval显示文摘Fox MA Chen RS Holmes CS 2003Journal of Pediatric Psychology2003,28,8:1
7Demographic risk factors, media- tors, and moderators in youths' diabetes metabolic control 显示文摘Holmes CS Swift EE Chen R 2006Ann Behav Med2006,32,1:1
8Applicability of distal protection fro aortocoronary vein graft interventions in clinical practice显示文摘Holmes DR Lennon RJ Rihal CS 2004Catheter Cardiovasc Interv2004,63,:1
9Behavior problems in children with diabetes:disentangling possible scoring con- founds on the child behavior checklist显示文摘Holmes CS Respess D Greer T et a/ 1998J Pediatr Psychol1998,23,3:1
10Prefrontal functioning during context processing in schizophrenia and major depression: an event-related fMRI study显示文摘Holmes AJ MacDonald AW 3rd Carter CS 2005Schizophr Res2005,76,23:1
11Orthostatic hypotension from sympathetic denervation in Parkinson's disease显示文摘Goldstein DS Holmes CS Dendi R 0,,08:1
12Chronic coro- nary artery disease: diagnosis and management显示文摘Cassar A Holmes DR Jr Rihal CS 2009Mayo Clin Proc2009,84,12:1
13Neonatal diagnosis and treatment of Menkes disease 显示文摘Kaler SG Holmes CS Goldstein DS 2008N Engl J Med2008,358,6:1
14The absence of apoeccrine glands in the human axilla has disease pathogenetic implications,including axillary hyperhidrosis 显示文摘Bovell DL Holmes CS MacDonald A 2007Br J Dermatol2007,156,6:1
15Orthostatic hypo- tension from sympathetic denervation in Parkinson's disease 显示文摘Goldstein DS Holmes CS Dendi R 2002Neurology2002,58,8:1
16Neonatal diagnosis and treat- ment of Menkes disease显示文摘Kaler SG Holmes CS Goldstein DS 2008N Engl J Med2008,358,6:1
17Chronic coronary artery disease: diagnosis and management 显示文摘Cassar A Holmes DR Jr Rihal CS 2009Mayo Clin Proc2009,84,12:1
18FOXA1 is a key determinant of estrogen receptor function and endocrine response显示文摘Hurtado A Holmes KA Ross-Innes CS 2011Nat Genet2011,43,1:1
19Predictors of youth dia- betes care behaviors and metabolic control : a structural equa- tion modeling approach 显示文摘Holmes CS Chen R Streisand R 2006J Pediatr Psychol2006,31,8:1
20In utero copper treatment for Menkes disease associated with a severe ATP7A mutation显示文摘Haddad MR Macri C J Holmes CS 0,,1:1
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